methyl 2-[(3-cyanophenyl)methyl]-5-phenyl-3-[(4-pyridin-3-ylphenyl)carbonylamino]pentanoate

Systemtic Name: methyl 2-[(3-cyanophenyl)methyl]-5-phenyl-3-[(4-pyridin-3-ylphenyl)carbonylamino]pentanoate Openeye Name: methyl 2-[(3-cyanophenyl)methyl]-5-phenyl-3-[[4-(3-pyridyl)benzoyl]amino]pentanoate CAS Name: 2-[(3-cyanophenyl)methyl]-3-[[oxo-[4-(3-pyridinyl)phenyl]methyl]amino]-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)methyl]-5-phenyl-3-[(4-pyridin-3-ylbenzoyl)amino]pentanoate Traditional Name: 2-(3-cyanobenzyl)-5-phenyl-3-[[4-(3-pyridyl)benzoyl]amino]valeric acid methyl ester Formula: C32H29N3O3 MolecularWeight: 503.59096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC(=C1)C#N)C(CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

COC(=O)C(CC1=CC=CC(=C1)C#N)C(CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CN=CC=C4

InChI

InChI=1S/C32H29N3O3/c1-38-32(37)29(20-24-9-5-10-25(19-24)21-33)30(17-12-23-7-3-2-4-8-23)35-31(36)27-15-13-26(14-16-27)28-11-6-18-34-22-28/h2-11,13-16,18-19,22,29-30H,12,17,20H2,1H3,(H,35,36)