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

Systemtic Name: 2-[[2-[(2-aminophenyl)carbonylamino]phenyl]methylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-[(2-aminobenzoyl)amino]phenyl]methylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-[[(2-aminophenyl)-oxomethyl]amino]phenyl]methylamino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-[(2-aminobenzoyl)amino]phenyl]methylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(anthraniloylamino)benzyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(CC2=CNC3=CC=CC=C32)C(=O)O)NC(=O)C4=CC=CC=C4N

Isomeric SMILES

C1=CC=C(C(=C1)CNC(CC2=CNC3=CC=CC=C32)C(=O)O)NC(=O)C4=CC=CC=C4N

InChI

InChI=1S/C25H24N4O3/c26-20-10-4-2-9-19(20)24(30)29-21-11-5-1-7-16(21)14-28-23(25(31)32)13-17-15-27-22-12-6-3-8-18(17)22/h1-12,15,23,27-28H,13-14,26H2,(H,29,30)(H,31,32)