1-(4-methoxyphenyl)-4-(phenylmethyl)-3-[(E)-3-piperazin-1-ylprop-1-enyl]cyclohexan-1-ol

Systemtic Name: 1-(4-methoxyphenyl)-4-(phenylmethyl)-3-[(E)-3-piperazin-1-ylprop-1-enyl]cyclohexan-1-ol Openeye Name: 4-benzyl-1-(4-methoxyphenyl)-3-[(E)-3-piperazin-1-ylprop-1-enyl]cyclohexanol CAS Name: 1-(4-methoxyphenyl)-4-(phenylmethyl)-3-[(E)-3-(1-piperazinyl)prop-1-enyl]-1-cyclohexanol IUPAC Name: 4-benzyl-1-(4-methoxyphenyl)-3-[(E)-3-piperazin-1-ylprop-1-enyl]cyclohexan-1-ol Traditional Name: 4-benzyl-1-(4-methoxyphenyl)-3-[(E)-3-piperazinoprop-1-enyl]cyclohexanol Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCC(C(C2)C=CCN3CCNCC3)CC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCC(C(C2)/C=C/CN3CCNCC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C27H36N2O2/c1-31-26-11-9-25(10-12-26)27(30)14-13-23(20-22-6-3-2-4-7-22)24(21-27)8-5-17-29-18-15-28-16-19-29/h2-12,23-24,28,30H,13-21H2,1H3/b8-5+