4-(3,4-dimethylphenyl)-2-pyridin-2-yl-phthalazin-1-one

Systemtic Name: 4-(3,4-dimethylphenyl)-2-pyridin-2-yl-phthalazin-1-one Openeye Name: 4-(3,4-dimethylphenyl)-2-(2-pyridyl)phthalazin-1-one CAS Name: 4-(3,4-dimethylphenyl)-2-(2-pyridinyl)-1-phthalazinone IUPAC Name: 4-(3,4-dimethylphenyl)-2-pyridin-2-ylphthalazin-1-one Traditional Name: 4-(3,4-dimethylphenyl)-2-(2-pyridyl)phthalazin-1-one Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=N4)C

InChI

InChI=1S/C21H17N3O/c1-14-10-11-16(13-15(14)2)20-17-7-3-4-8-18(17)21(25)24(23-20)19-9-5-6-12-22-19/h3-13H,1-2H3