3-[(2-methylphenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[(2-methylphenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-(o-tolylmethyl)-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[(2-methylphenyl)methyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[(2-methylphenyl)methyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 4-keto-3-(2-methylbenzyl)phthalazine-1-carboxylic acid Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C17H14N2O3/c1-11-6-2-3-7-12(11)10-19-16(20)14-9-5-4-8-13(14)15(18-19)17(21)22/h2-9H,10H2,1H3,(H,21,22)