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

Systemtic Name: 3-(3-chlorophenyl)-2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-(3-chlorophenyl)-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]propanoic acid CAS Name: 3-(3-chlorophenyl)-2-[[[2-[[1H-indol-2-yl(oxo)methyl]amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3-chlorophenyl)-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]propanoic acid Traditional Name: 3-(3-chlorophenyl)-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]propionic acid Formula: C25H20ClN3O4 MolecularWeight: 461.897

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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(=CC=C4)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)C(=O)NC3=CC=CC=C3C(=O)NC(CC4=CC(=CC=C4)Cl)C(=O)O

InChI

InChI=1S/C25H20ClN3O4/c26-17-8-5-6-15(12-17)13-22(25(32)33)29-23(30)18-9-2-4-11-20(18)28-24(31)21-14-16-7-1-3-10-19(16)27-21/h1-12,14,22,27H,13H2,(H,28,31)(H,29,30)(H,32,33)