(2-methylphenyl) 2-(4-pyridin-4-ylpiperazin-1-yl)butanoate

Systemtic Name: (2-methylphenyl) 2-(4-pyridin-4-ylpiperazin-1-yl)butanoate Openeye Name: o-tolyl 2-[4-(4-pyridyl)piperazin-1-yl]butanoate CAS Name: 2-(4-pyridin-4-yl-1-piperazinyl)butanoic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 2-(4-pyridin-4-ylpiperazin-1-yl)butanoate Traditional Name: 2-[4-(4-pyridyl)piperazino]butyric acid o-tolyl ester Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=CC=CC=C1C)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCC(C(=O)OC1=CC=CC=C1C)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C20H25N3O2/c1-3-18(20(24)25-19-7-5-4-6-16(19)2)23-14-12-22(13-15-23)17-8-10-21-11-9-17/h4-11,18H,3,12-15H2,1-2H3