ethyl 1-[1-[(4-fluorophenyl)methyl]-6-phenyl-piperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[(4-fluorophenyl)methyl]-6-phenyl-piperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-[(4-fluorophenyl)methyl]-6-phenyl-piperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[(4-fluorophenyl)methyl]-6-phenyl-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(4-fluorophenyl)methyl]-6-phenylpiperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(4-fluorobenzyl)-6-phenyl-nipecotoyl]nipecotic acid ethyl ester Formula: C27H33FN2O3 MolecularWeight: 452.560923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCC(N(C2)CC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCC(N(C2)CC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C27H33FN2O3/c1-2-33-27(32)23-9-6-16-29(19-23)26(31)22-12-15-25(21-7-4-3-5-8-21)30(18-22)17-20-10-13-24(28)14-11-20/h3-5,7-8,10-11,13-14,22-23,25H,2,6,9,12,15-19H2,1H3