2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]-N-isobutyl-acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]-N-(2-methylpropyl)acetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]-N-isobutyl-acetamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2/c1-14(2)12-23-20(26)13-25-22(27)18-8-6-5-7-17(18)21(24-25)19-11-15(3)9-10-16(19)4/h5-11,14H,12-13H2,1-4H3,(H,23,26)