5-cyano-2-[(1-methyl-7-oxidanyl-indol-2-yl)carbonylamino]benzoic acid

Systemtic Name: 5-cyano-2-[(1-methyl-7-oxidanyl-indol-2-yl)carbonylamino]benzoic acid Openeye Name: 5-cyano-2-[(7-hydroxy-1-methyl-indole-2-carbonyl)amino]benzoic acid CAS Name: 5-cyano-2-[[(7-hydroxy-1-methyl-2-indolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 5-cyano-2-[(7-hydroxy-1-methylindole-2-carbonyl)amino]benzoic acid Traditional Name: 5-cyano-2-[(7-hydroxy-1-methyl-indole-2-carbonyl)amino]benzoic acid Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)O)C(=O)NC3=C(C=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)O)C(=O)NC3=C(C=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C18H13N3O4/c1-21-14(8-11-3-2-4-15(22)16(11)21)17(23)20-13-6-5-10(9-19)7-12(13)18(24)25/h2-8,22H,1H3,(H,20,23)(H,24,25)