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

Systemtic Name: methyl 4-[4-[4-(4-ethylcyclohexyl)piperazin-1-yl]phenyl]benzoate Openeye Name: methyl 4-[4-[4-(4-ethylcyclohexyl)piperazin-1-yl]phenyl]benzoate CAS Name: 4-[4-[4-(4-ethylcyclohexyl)-1-piperazinyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[4-(4-ethylcyclohexyl)piperazin-1-yl]phenyl]benzoate Traditional Name: 4-[4-[4-(4-ethylcyclohexyl)piperazino]phenyl]benzoic acid methyl ester Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCC1CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H34N2O2/c1-3-20-4-12-24(13-5-20)27-16-18-28(19-17-27)25-14-10-22(11-15-25)21-6-8-23(9-7-21)26(29)30-2/h6-11,14-15,20,24H,3-5,12-13,16-19H2,1-2H3