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 7 results

Search term: ZEXPJNALIUUXEL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3068333

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3
C17H21NO4303.3529231300
1394091

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/t11-,12+
C17H21NO4303.35293200
1394095

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/t11-,12-/m1/s1
C17H21NO4303.35292100
1394097

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/t11-,12-/m0/s1
C17H21NO4303.35292100
1394090

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/p+1/t11-,12+
C17H22NO4304.36031100
1394096

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/p+1/t11-,12-/m0/s1
C17H22NO4304.36031100
1394094

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H21NO4/c1-11-8-18(9-12(2)21-11)10-13-6-17(19)22-16-7-14(20-3)4-5-15(13)16/h4-7,11-12H,8-10H2,1-3H3/p+1/t11-,12-/m1/s1
C17H22NO4304.36031100

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