[5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-phenyl-2-pyridin-2-yl-pentyl] 4-azanyl-4-oxidanylidene-butanoate

Systemtic Name: [5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-phenyl-2-pyridin-2-yl-pentyl] 4-azanyl-4-oxidanylidene-butanoate Openeye Name: [5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-phenyl-2-(2-pyridyl)pentyl] 4-amino-4-oxo-butanoate CAS Name: 4-amino-4-oxobutanoic acid [5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-phenyl-2-(2-pyridinyl)pentyl] ester IUPAC Name: [5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-phenyl-2-pyridin-2-ylpentyl] 4-amino-4-oxobutanoate Traditional Name: 4-amino-4-keto-butyric acid [5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-phenyl-2-(2-pyridyl)pentyl] ester Formula: C31H36ClN3O4 MolecularWeight: 550.08824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(COC(=O)CCC(=O)N)(C3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(COC(=O)CCC(=O)N)(C3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C31H36ClN3O4/c32-26-12-10-25(11-13-26)31(38)17-21-35(22-18-31)20-6-16-30(24-7-2-1-3-8-24,27-9-4-5-19-34-27)23-39-29(37)15-14-28(33)36/h1-5,7-13,19,38H,6,14-18,20-23H2,(H2,33,36)