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

Systemtic Name: 2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]-3-(4-methylphenyl)propanoic acid Openeye Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(p-tolyl)propanoic acid CAS Name: 2-[[[2-[[1H-indol-2-yl(oxo)methyl]amino]phenyl]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid IUPAC Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(4-methylphenyl)propanoic acid Traditional Name: 2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-(p-tolyl)propionic acid Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C26H23N3O4/c1-16-10-12-17(13-11-16)14-23(26(32)33)29-24(30)19-7-3-5-9-21(19)28-25(31)22-15-18-6-2-4-8-20(18)27-22/h2-13,15,23,27H,14H2,1H3,(H,28,31)(H,29,30)(H,32,33)