propan-2-yl 3-(4-methylphenyl)-3-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(4-methylphenyl)-3-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbonylamino]propanoate Openeye Name: isopropyl 3-(p-tolyl)-3-[[3-(pyridine-3-carbonylamino)benzoyl]amino]propanoate CAS Name: 3-(4-methylphenyl)-3-[[oxo-[3-[[oxo(3-pyridinyl)methyl]amino]phenyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(4-methylphenyl)-3-[[3-(pyridine-3-carbonylamino)benzoyl]amino]propanoate Traditional Name: 3-[(3-nicotinamidobenzoyl)amino]-3-(p-tolyl)propionic acid isopropyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C26H27N3O4/c1-17(2)33-24(30)15-23(19-11-9-18(3)10-12-19)29-25(31)20-6-4-8-22(14-20)28-26(32)21-7-5-13-27-16-21/h4-14,16-17,23H,15H2,1-3H3,(H,28,32)(H,29,31)