methyl 2-[[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoyl]amino]benzoate CAS Name: 2-[[[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoyl]amino]benzoate Traditional Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]benzoyl]amino]benzoic acid methyl ester Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2NC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2NC(=O)C(CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C26H24N4O4/c1-34-26(33)19-10-4-7-13-23(19)29-24(31)18-9-3-6-12-22(18)30-25(32)20(27)14-16-15-28-21-11-5-2-8-17(16)21/h2-13,15,20,28H,14,27H2,1H3,(H,29,31)(H,30,32)