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: QWFRRFLKWRIKSZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
70589

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)
C18H16O4296.3172422904
10218892

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/t13-,14-,15-,16-
C18H16O4296.3172202900
16736202

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/t13-,14+,15-,16-
C18H16O4296.31726600
22903858

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/t13?,14?,15-,16?
C18H16O4296.31723100
12520667

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/p-2/t13-,14-,15-,16-
C18H14O4294.30252100
5323549

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/p-2
C18H14O4294.301361100
71081431

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/t13?,14?,15-,16-
C18H16O4296.31721100

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