2-[4-[(3,4-dimethyl-6-oxidanylidene-1H-pyridazin-5-yl)carbonyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(3,4-dimethyl-6-oxidanylidene-1H-pyridazin-5-yl)carbonyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3,4-dimethyl-6-oxo-1H-pyridazine-5-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(3,4-dimethyl-6-oxo-1H-pyridazin-5-yl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3,4-dimethyl-6-oxo-1H-pyridazine-5-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(6-keto-3,4-dimethyl-1H-pyridazine-5-carbonyl)piperazino]acetic acid Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=C(C(=O)NN=C1C)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H18N4O4/c1-8-9(2)14-15-12(20)11(8)13(21)17-5-3-16(4-6-17)7-10(18)19/h3-7H2,1-2H3,(H,15,20)(H,18,19)