[3-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]phenyl] propanoate

Systemtic Name: [3-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]phenyl] propanoate Openeye Name: [3-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]phenyl] propanoate CAS Name: propanoic acid [3-[2-(4-cyclohexyl-1-piperazinyl)-2-phenylethyl]phenyl] ester IUPAC Name: [3-[2-(4-cyclohexylpiperazin-1-yl)-2-phenylethyl]phenyl] propanoate Traditional Name: propionic acid [3-[2-(4-cyclohexylpiperazino)-2-phenyl-ethyl]phenyl] ester Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)CC(C2=CC=CC=C2)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)CC(C2=CC=CC=C2)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C27H36N2O2/c1-2-27(30)31-25-15-9-10-22(20-25)21-26(23-11-5-3-6-12-23)29-18-16-28(17-19-29)24-13-7-4-8-14-24/h3,5-6,9-12,15,20,24,26H,2,4,7-8,13-14,16-19,21H2,1H3