Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 17 results

Search term: MSHZHSPISPJWHW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
328427

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18+,19+/m1/s1
C19H28ClNO6401.8817577300
54787

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)
C19H28ClNO6401.8817111300
8106563

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18?,19+/m1/s1
C19H28ClNO6401.88177700
26567468

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13?,15-,16-,18+,19+/m1/s1
C19H28ClNO6401.88174300
21246977

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13+,15-,16-,18-,19+/m1/s1
C19H28ClNO6401.88173200
8084706

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18-,19+/m1/s1
C19H28ClNO6401.88173200
5010254

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16?,18+,19+/m1/s1
C19H28ClNO6401.88172200
23199999

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15+,16+,18-,19-/m0/s1
C19H28ClNO6401.88172200
24637517

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16+,18+,19+/m1/s1
C19H28ClNO6401.88172200
29774114

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13?,15-,16-,18?,19+/m1/s1
C19H28ClNO6401.88172100
30792750

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13?,15-,16?,18-,19+/m1/s1
C19H28ClNO6401.88171100
78429691

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13+,15-,16+,18-,19+/m1/s1
C19H28ClNO6401.88171100
78432053

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12?,13?,15?,16-,18+,19+/m1/s1
C19H28ClNO6401.88171100
78433138

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12?,13-,15-,16-,18+,19+/m1/s1
C19H28ClNO6401.88171100
78433166

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12?,13-,15?,16?,18?,19+/m1/s1
C19H28ClNO6401.88171100
78433804

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13+,15-,16?,18?,19+/m1/s1
C19H28ClNO6401.88171100

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