2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]-3-(4-nitrophenyl)propanoic acid

Systemtic Name: 2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]-3-(4-nitrophenyl)propanoic acid Openeye Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(4-nitrophenyl)propanoic acid CAS Name: 2-[[[2-[[1H-indol-2-yl(oxo)methyl]amino]phenyl]-oxomethyl]amino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(4-nitrophenyl)propanoic acid Traditional Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(4-nitrophenyl)propionic acid Formula: C25H20N4O6 MolecularWeight: 472.4495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)C(=O)NC3=CC=CC=C3C(=O)NC(CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)C(=O)NC3=CC=CC=C3C(=O)NC(CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C25H20N4O6/c30-23(28-22(25(32)33)13-15-9-11-17(12-10-15)29(34)35)18-6-2-4-8-20(18)27-24(31)21-14-16-5-1-3-7-19(16)26-21/h1-12,14,22,26H,13H2,(H,27,31)(H,28,30)(H,32,33)