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 4 results

Search term: NOPXWCINYMGLJW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
6448756

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-8-12-14(20)18-11(7-17-9(2)10-5-4-6-23-10)19-15(12)24-13(8)16(21)22-3/h4-6,9,17H,7H2,1-3H3,(H,18,19,20)/t9-/m0/s1
C16H17N3O4S347.38892100
6448760

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-8-12-14(20)18-11(7-17-9(2)10-5-4-6-23-10)19-15(12)24-13(8)16(21)22-3/h4-6,9,17H,7H2,1-3H3,(H,18,19,20)/t9-/m1/s1
C16H17N3O4S347.38892100
6448755

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-8-12-14(20)18-11(7-17-9(2)10-5-4-6-23-10)19-15(12)24-13(8)16(21)22-3/h4-6,9,17H,7H2,1-3H3,(H,18,19,20)/p+1/t9-/m0/s1
C16H18N3O4S348.39631100
6448759

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-8-12-14(20)18-11(7-17-9(2)10-5-4-6-23-10)19-15(12)24-13(8)16(21)22-3/h4-6,9,17H,7H2,1-3H3,(H,18,19,20)/p+1/t9-/m1/s1
C16H18N3O4S348.39631100

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