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

Systemtic Name: 4-[4-(3-methylphenyl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(m-tolyl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-(3-methylphenyl)-1-piperazinyl]-4-oxobutanoate IUPAC Name: 4-[4-(3-methylphenyl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[4-(m-tolyl)piperazino]butyrate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H20N2O3/c1-12-3-2-4-13(11-12)16-7-9-17(10-8-16)14(18)5-6-15(19)20/h2-4,11H,5-10H2,1H3,(H,19,20)/p-1