methyl 4-[[4-(4-cyclohexylphenyl)piperazin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-(4-cyclohexylphenyl)piperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(4-cyclohexylphenyl)piperazin-1-yl]methyl]benzoate CAS Name: 4-[[4-(4-cyclohexylphenyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-cyclohexylphenyl)piperazin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(4-cyclohexylphenyl)piperazino]methyl]benzoic acid methyl ester Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C25H32N2O2/c1-29-25(28)23-9-7-20(8-10-23)19-26-15-17-27(18-16-26)24-13-11-22(12-14-24)21-5-3-2-4-6-21/h7-14,21H,2-6,15-19H2,1H3