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

Systemtic Name: N-[(2-methylphenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(o-tolylmethyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(2-methylbenzyl)phthalazine-1-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C21H23N3O2/c1-14(2)13-24-21(26)18-11-7-6-10-17(18)19(23-24)20(25)22-12-16-9-5-4-8-15(16)3/h4-11,14H,12-13H2,1-3H3,(H,22,25)