ethyl 4-[2-(3-chlorophenyl)ethanoyl-phenyl-amino]-1-cyclopentyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-[2-(3-chlorophenyl)ethanoyl-phenyl-amino]-1-cyclopentyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(N-[2-(3-chlorophenyl)acetyl]anilino)-1-cyclopentyl-piperidine-4-carboxylate CAS Name: 4-(N-[2-(3-chlorophenyl)-1-oxoethyl]anilino)-1-cyclopentyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(N-[2-(3-chlorophenyl)acetyl]anilino)-1-cyclopentylpiperidine-4-carboxylate Traditional Name: 4-(N-[2-(3-chlorophenyl)acetyl]anilino)-1-cyclopentyl-isonipecotic acid ethyl ester Formula: C27H33ClN2O3 MolecularWeight: 469.01552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C2CCCC2)N(C3=CC=CC=C3)C(=O)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C2CCCC2)N(C3=CC=CC=C3)C(=O)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H33ClN2O3/c1-2-33-26(32)27(15-17-29(18-16-27)23-11-6-7-12-23)30(24-13-4-3-5-14-24)25(31)20-21-9-8-10-22(28)19-21/h3-5,8-10,13-14,19,23H,2,6-7,11-12,15-18,20H2,1H3