3-[4-(2-methylpropyl)-3-oxidanylidene-1,2-diazinan-1-yl]benzenecarbonitrile

Systemtic Name: 3-[4-(2-methylpropyl)-3-oxidanylidene-1,2-diazinan-1-yl]benzenecarbonitrile Openeye Name: 3-(4-isobutyl-3-oxo-hexahydropyridazin-1-yl)benzonitrile CAS Name: 3-[4-(2-methylpropyl)-3-oxo-1-diazinanyl]benzonitrile IUPAC Name: 3-[4-(2-methylpropyl)-3-oxodiazinan-1-yl]benzonitrile Traditional Name: 3-(4-isobutyl-3-keto-hexahydropyridazin-1-yl)benzonitrile Formula: C15H19N3O MolecularWeight: 257.33086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CCN(NC1=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)CC1CCN(NC1=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H19N3O/c1-11(2)8-13-6-7-18(17-15(13)19)14-5-3-4-12(9-14)10-16/h3-5,9,11,13H,6-8H2,1-2H3,(H,17,19)