ethyl 4-(4-phenethylpiperazin-1-yl)-1-phenyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 4-(4-phenethylpiperazin-1-yl)-1-phenyl-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 4-(4-phenethylpiperazin-1-yl)-1-phenyl-cyclohex-2-ene-1-carboxylate CAS Name: 4-(4-phenethyl-1-piperazinyl)-1-phenyl-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-phenethylpiperazin-1-yl)-1-phenylcyclohex-2-ene-1-carboxylate Traditional Name: 4-(4-phenethylpiperazino)-1-phenyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(C=C1)N2CCN(CC2)CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCC(C=C1)N2CCN(CC2)CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N2O2/c1-2-31-26(30)27(24-11-7-4-8-12-24)16-13-25(14-17-27)29-21-19-28(20-22-29)18-15-23-9-5-3-6-10-23/h3-13,16,25H,2,14-15,17-22H2,1H3