4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanoate

Systemtic Name: 4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: 2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxo-butanoate CAS Name: 4-(4-methyl-1-piperazinyl)-4-oxo-2-(phenylmethyl)butanoate IUPAC Name: 2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxobutanoate Traditional Name: 2-benzyl-4-keto-4-(4-methylpiperazino)butyrate Formula: C16H21N2O3- MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)CC(CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H22N2O3/c1-17-7-9-18(10-8-17)15(19)12-14(16(20)21)11-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3,(H,20,21)/p-1