methyl 4-[4-(3-methylphenyl)piperazin-1-yl]butanoate

Systemtic Name: methyl 4-[4-(3-methylphenyl)piperazin-1-yl]butanoate Openeye Name: methyl 4-[4-(m-tolyl)piperazin-1-yl]butanoate CAS Name: 4-[4-(3-methylphenyl)-1-piperazinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(3-methylphenyl)piperazin-1-yl]butanoate Traditional Name: 4-[4-(m-tolyl)piperazino]butyric acid methyl ester Formula: C16H24N2O2 MolecularWeight: 276.37396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCC(=O)OC

InChI

InChI=1S/C16H24N2O2/c1-14-5-3-6-15(13-14)18-11-9-17(10-12-18)8-4-7-16(19)20-2/h3,5-6,13H,4,7-12H2,1-2H3