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: RVOMZLJKDLSPIS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7866013

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)/b17-10+
C16H19N3O4S349.4048221900
2359818

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)
C16H19N3O4S349.404765200
5255453

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)/b17-10-/t13-/m0/s1
C16H19N3O4S349.40483200
5255452

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)/p-1/b17-10-/t13-/m0/s1
C16H18N3O4S348.39742200
5554178

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)/b17-10-/t13-/m1/s1
C16H19N3O4S349.40482100
5554177

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O4S/c1-2-3-8-23-12-6-4-11(5-7-12)10-17-19-16-18-15(22)13(24-16)9-14(20)21/h4-7,10,13H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)/p-1/b17-10-/t13-/m1/s1
C16H18N3O4S348.39741100

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