3-(3,4-dimethylphenyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-(3,4-dimethylphenyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-(3,4-dimethylphenyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(3,4-dimethylphenyl)-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-(3,4-dimethylphenyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(3,4-dimethylphenyl)-4-keto-phthalazine-1-carboxylate Formula: C17H13N2O3- MolecularWeight: 293.29672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

InChI

InChI=1S/C17H14N2O3/c1-10-7-8-12(9-11(10)2)19-16(20)14-6-4-3-5-13(14)15(18-19)17(21)22/h3-9H,1-2H3,(H,21,22)/p-1