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

Systemtic Name: 3-methyl-4-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]benzoic acid CAS Name: 3-methyl-4-[[oxo-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]benzoic acid Traditional Name: 4-[(6-keto-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]-3-methyl-benzoic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=NNC(=O)CC2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=NNC(=O)CC2

InChI

InChI=1S/C13H13N3O4/c1-7-6-8(13(19)20)2-3-9(7)14-12(18)10-4-5-11(17)16-15-10/h2-3,6H,4-5H2,1H3,(H,14,18)(H,16,17)(H,19,20)