2-[[2-[(2-aminophenyl)carbonylamino]phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[2-[(2-aminophenyl)carbonylamino]phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-[(2-aminobenzoyl)amino]benzoyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[[2-[[(2-aminophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-[(2-aminobenzoyl)amino]benzoyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(anthraniloylamino)benzoyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4N

InChI

InChI=1S/C25H22N4O4/c26-19-10-4-1-8-17(19)23(30)28-21-12-6-3-9-18(21)24(31)29-22(25(32)33)13-15-14-27-20-11-5-2-7-16(15)20/h1-12,14,22,27H,13,26H2,(H,28,30)(H,29,31)(H,32,33)