ethyl 1-[1-(4-fluorophenyl)carbonyl-6-(3-methylphenyl)piperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(4-fluorophenyl)carbonyl-6-(3-methylphenyl)piperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(4-fluorobenzoyl)-6-(m-tolyl)piperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[(4-fluorophenyl)-oxomethyl]-6-(3-methylphenyl)-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-fluorobenzoyl)-6-(3-methylphenyl)piperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(4-fluorobenzoyl)-6-(m-tolyl)nipecotoyl]nipecotic acid ethyl ester Formula: C28H33FN2O4 MolecularWeight: 480.571023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33FN2O4/c1-3-35-28(34)23-8-5-15-30(17-23)26(32)22-11-14-25(21-7-4-6-19(2)16-21)31(18-22)27(33)20-9-12-24(29)13-10-20/h4,6-7,9-10,12-13,16,22-23,25H,3,5,8,11,14-15,17-18H2,1-2H3