ethyl 1-[1-[(4-chlorophenyl)carbamoyl]-5-phenyl-piperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[(4-chlorophenyl)carbamoyl]-5-phenyl-piperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-[(4-chlorophenyl)carbamoyl]-5-phenyl-piperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[(4-chloroanilino)-oxomethyl]-5-phenyl-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(4-chlorophenyl)carbamoyl]-5-phenylpiperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-[(4-chlorophenyl)carbamoyl]-5-phenyl-nipecotoyl]nipecotic acid ethyl ester Formula: C27H32ClN3O4 MolecularWeight: 498.01368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CC(CN(C2)C(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CC(CN(C2)C(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C27H32ClN3O4/c1-2-35-26(33)20-9-6-14-30(16-20)25(32)22-15-21(19-7-4-3-5-8-19)17-31(18-22)27(34)29-24-12-10-23(28)11-13-24/h3-5,7-8,10-13,20-22H,2,6,9,14-18H2,1H3,(H,29,34)