methyl (2R)-3-(1H-indol-3-yl)-2-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbonylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[3-(pyridine-3-carbonylamino)benzoyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[oxo-[3-[[oxo(3-pyridinyl)methyl]amino]phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[3-(pyridine-3-carbonylamino)benzoyl]amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(3-nicotinamidobenzoyl)amino]propionic acid methyl ester Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H22N4O4/c1-33-25(32)22(13-18-15-27-21-10-3-2-9-20(18)21)29-23(30)16-6-4-8-19(12-16)28-24(31)17-7-5-11-26-14-17/h2-12,14-15,22,27H,13H2,1H3,(H,28,31)(H,29,30)/t22-/m1/s1