5-[4-(4-methylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[4-(4-methylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-oxo-5-[4-(p-tolyl)piperazin-1-yl]pentanoate CAS Name: 5-[4-(4-methylphenyl)-1-piperazinyl]-5-oxopentanoate IUPAC Name: 5-[4-(4-methylphenyl)piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-keto-5-[4-(p-tolyl)piperazino]valerate Formula: C16H21N2O3- MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3/c1-13-5-7-14(8-6-13)17-9-11-18(12-10-17)15(19)3-2-4-16(20)21/h5-8H,2-4,9-12H2,1H3,(H,20,21)/p-1