3-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2,4-dimethylphenyl)propanamide

Systemtic Name: 3-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2,4-dimethylphenyl)propanamide Openeye Name: 3-[4-(4-chlorophenyl)-1-oxo-phthalazin-2-yl]-N-(2,4-dimethylphenyl)propanamide CAS Name: 3-[4-(4-chlorophenyl)-1-oxo-2-phthalazinyl]-N-(2,4-dimethylphenyl)propanamide IUPAC Name: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-(2,4-dimethylphenyl)propanamide Traditional Name: 3-[4-(4-chlorophenyl)-1-keto-phthalazin-2-yl]-N-(2,4-dimethylphenyl)propionamide Formula: C25H22ClN3O2 MolecularWeight: 431.91408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H22ClN3O2/c1-16-7-12-22(17(2)15-16)27-23(30)13-14-29-25(31)21-6-4-3-5-20(21)24(28-29)18-8-10-19(26)11-9-18/h3-12,15H,13-14H2,1-2H3,(H,27,30)