ethyl 4-[4-(4-chlorophenyl)piperazin-1-yl]-1-phenyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 4-[4-(4-chlorophenyl)piperazin-1-yl]-1-phenyl-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 4-[4-(4-chlorophenyl)piperazin-1-yl]-1-phenyl-cyclohex-2-ene-1-carboxylate CAS Name: 4-[4-(4-chlorophenyl)-1-piperazinyl]-1-phenyl-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-chlorophenyl)piperazin-1-yl]-1-phenylcyclohex-2-ene-1-carboxylate Traditional Name: 4-[4-(4-chlorophenyl)piperazino]-1-phenyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(C=C1)N2CCN(CC2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCC(C=C1)N2CCN(CC2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H29ClN2O2/c1-2-30-24(29)25(20-6-4-3-5-7-20)14-12-23(13-15-25)28-18-16-27(17-19-28)22-10-8-21(26)9-11-22/h3-12,14,23H,2,13,15-19H2,1H3