4-[[(1-methyl-6-oxidanylidene-4,5-dihydropyridazin-3-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(1-methyl-6-oxidanylidene-4,5-dihydropyridazin-3-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(6-keto-1-methyl-4,5-dihydropyridazine-3-carbonyl)amino]methyl]benzoic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC(=N1)C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=O)CCC(=N1)C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-17-12(18)7-6-11(16-17)13(19)15-8-9-2-4-10(5-3-9)14(20)21/h2-5H,6-8H2,1H3,(H,15,19)(H,20,21)