ethyl 1-[4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[4-[[4-(2-fluorophenyl)-1-piperazinyl]methyl]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[4-[[4-(2-fluorophenyl)piperazino]methyl]benzoyl]nipecotic acid ethyl ester Formula: C26H32FN3O3 MolecularWeight: 453.548983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C26H32FN3O3/c1-2-33-26(32)22-6-5-13-30(19-22)25(31)21-11-9-20(10-12-21)18-28-14-16-29(17-15-28)24-8-4-3-7-23(24)27/h3-4,7-12,22H,2,5-6,13-19H2,1H3