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

Systemtic Name: 4-[4-(3-methylbutanoyl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(3-methylbutanoyl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-4-oxobutanoate IUPAC Name: 4-[4-(3-methylbutanoyl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-(4-isovalerylpiperazino)-4-keto-butyrate Formula: C13H21N2O4- MolecularWeight: 269.31684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H22N2O4/c1-10(2)9-12(17)15-7-5-14(6-8-15)11(16)3-4-13(18)19/h10H,3-9H2,1-2H3,(H,18,19)/p-1