5-[4-(3-methylphenyl)carbonylpiperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[4-(3-methylphenyl)carbonylpiperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[4-(3-methylbenzoyl)piperazin-1-yl]-5-oxo-pentanoate CAS Name: 5-[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]-5-oxopentanoate IUPAC Name: 5-[4-(3-methylbenzoyl)piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-keto-5-(4-m-toluoylpiperazino)valerate Formula: C17H21N2O4- MolecularWeight: 317.35964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O4/c1-13-4-2-5-14(12-13)17(23)19-10-8-18(9-11-19)15(20)6-3-7-16(21)22/h2,4-5,12H,3,6-11H2,1H3,(H,21,22)/p-1