methyl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate

Systemtic Name: methyl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate Openeye Name: methyl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate CAS Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]-1-piperazinyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate Traditional Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazino]phenyl]benzoic acid methyl ester Formula: C31H36N2O3 MolecularWeight: 484.62914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC(CC2)N3CCN(CC3)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CCC(CC2)N3CCN(CC3)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C31H36N2O3/c1-35-30-17-11-26(12-18-30)25-9-15-29(16-10-25)33-21-19-32(20-22-33)28-13-7-24(8-14-28)23-3-5-27(6-4-23)31(34)36-2/h3-8,11-14,17-18,25,29H,9-10,15-16,19-22H2,1-2H3