ethyl 1-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 1-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 4-(4-benzyl-1-piperidyl)-1-phenyl-cyclohex-2-ene-1-carboxylate CAS Name: 1-phenyl-4-[4-(phenylmethyl)-1-piperidinyl]-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-benzylpiperidin-1-yl)-1-phenylcyclohex-2-ene-1-carboxylate Traditional Name: 4-(4-benzylpiperidino)-1-phenyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C27H33NO2 MolecularWeight: 403.55642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCC(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H33NO2/c1-2-30-26(29)27(24-11-7-4-8-12-24)17-13-25(14-18-27)28-19-15-23(16-20-28)21-22-9-5-3-6-10-22/h3-13,17,23,25H,2,14-16,18-21H2,1H3