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 6 results

Search term: NEPGVIUKFMUPGZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
506985

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2
C16H18N2O2S302.3913302400
1157106

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2/t16-/m0/s1
C16H18N2O2S302.39132100
1157107

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2/t16-/m1/s1
C16H18N2O2S302.39132100
3280693

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2/p+1
C16H19N2O2S303.39871100
5352728

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2/p+1/t16-/m0/s1
C16H19N2O2S303.39871100
5352729

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18N2O2S/c19-21(20,14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-17-16/h1-9,16-18H,10-12H2/p+1/t16-/m1/s1
C16H19N2O2S303.39871100

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