2-(2-methylpropanoyl)-1H-phthalazine-1-carbonitrile

Systemtic Name: 2-(2-methylpropanoyl)-1H-phthalazine-1-carbonitrile Openeye Name: 2-(2-methylpropanoyl)-1H-phthalazine-1-carbonitrile CAS Name: 2-(2-methyl-1-oxopropyl)-1H-phthalazine-1-carbonitrile IUPAC Name: 2-(2-methylpropanoyl)-1H-phthalazine-1-carbonitrile Traditional Name: 2-isobutyryl-1H-phthalazine-1-carbonitrile Formula: C13H13N3O MolecularWeight: 227.26182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(C2=CC=CC=C2C=N1)C#N

Isomeric SMILES

CC(C)C(=O)N1C(C2=CC=CC=C2C=N1)C#N

InChI

InChI=1S/C13H13N3O/c1-9(2)13(17)16-12(7-14)11-6-4-3-5-10(11)8-15-16/h3-6,8-9,12H,1-2H3