2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]benzoic acid

Systemtic Name: 2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]benzoic acid Openeye Name: 2-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]benzoic acid CAS Name: 2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]benzoic acid Traditional Name: 2-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]benzoic acid Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H13N3O4/c1-20-16(22)11-7-3-2-6-10(11)14(19-20)15(21)18-13-9-5-4-8-12(13)17(23)24/h2-9H,1H3,(H,18,21)(H,23,24)