2-[(7-acetamido-1H-indol-2-yl)carbonylamino]-5-cyano-benzoic acid

Systemtic Name: 2-[(7-acetamido-1H-indol-2-yl)carbonylamino]-5-cyano-benzoic acid Openeye Name: 2-[(7-acetamido-1H-indole-2-carbonyl)amino]-5-cyano-benzoic acid CAS Name: 2-[[(7-acetamido-1H-indol-2-yl)-oxomethyl]amino]-5-cyanobenzoic acid IUPAC Name: 2-[(7-acetamido-1H-indole-2-carbonyl)amino]-5-cyanobenzoic acid Traditional Name: 2-[(7-acetamido-1H-indole-2-carbonyl)amino]-5-cyano-benzoic acid Formula: C19H14N4O4 MolecularWeight: 362.33886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC2=C1NC(=C2)C(=O)NC3=C(C=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC2=C1NC(=C2)C(=O)NC3=C(C=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C19H14N4O4/c1-10(24)21-15-4-2-3-12-8-16(22-17(12)15)18(25)23-14-6-5-11(9-20)7-13(14)19(26)27/h2-8,22H,1H3,(H,21,24)(H,23,25)(H,26,27)