4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)benzoic acid

Systemtic Name: 4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)benzoic acid Openeye Name: 4-(3-methyl-4-oxo-phthalazin-1-yl)benzoic acid CAS Name: 4-(3-methyl-4-oxo-1-phthalazinyl)benzoic acid IUPAC Name: 4-(3-methyl-4-oxophthalazin-1-yl)benzoic acid Traditional Name: 4-(4-keto-3-methyl-phthalazin-1-yl)benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12N2O3/c1-18-15(19)13-5-3-2-4-12(13)14(17-18)10-6-8-11(9-7-10)16(20)21/h2-9H,1H3,(H,20,21)