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

Systemtic Name: methyl 5-phenyl-2-(2-piperidin-4-ylethyl)-3-[(4-pyridin-3-ylphenyl)carbonylamino]pentanoate Openeye Name: methyl 5-phenyl-2-[2-(4-piperidyl)ethyl]-3-[[4-(3-pyridyl)benzoyl]amino]pentanoate CAS Name: 3-[[oxo-[4-(3-pyridinyl)phenyl]methyl]amino]-5-phenyl-2-[2-(4-piperidinyl)ethyl]pentanoic acid methyl ester IUPAC Name: methyl 5-phenyl-2-(2-piperidin-4-ylethyl)-3-[(4-pyridin-3-ylbenzoyl)amino]pentanoate Traditional Name: 5-phenyl-2-[2-(4-piperidyl)ethyl]-3-[[4-(3-pyridyl)benzoyl]amino]valeric acid methyl ester Formula: C31H37N3O3 MolecularWeight: 499.64378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1CCNCC1)C(CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

COC(=O)C(CCC1CCNCC1)C(CCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CN=CC=C4

InChI

InChI=1S/C31H37N3O3/c1-37-31(36)28(15-9-24-17-20-32-21-18-24)29(16-10-23-6-3-2-4-7-23)34-30(35)26-13-11-25(12-14-26)27-8-5-19-33-22-27/h2-8,11-14,19,22,24,28-29,32H,9-10,15-18,20-21H2,1H3,(H,34,35)