N-(3-methylphenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-methylphenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(m-tolyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-methylphenyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-methylphenyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(m-tolyl)phthalazine-1-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2/c1-13(2)12-23-20(25)17-10-5-4-9-16(17)18(22-23)19(24)21-15-8-6-7-14(3)11-15/h4-11,13H,12H2,1-3H3,(H,21,24)