3-(4-butyl-3-oxidanylidene-1,2-diazinan-1-yl)benzenecarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(NC1=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCC1CCN(NC1=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H19N3O/c1-2-3-6-13-8-9-18(17-15(13)19)14-7-4-5-12(10-14)11-16/h4-5,7,10,13H,2-3,6,8-9H2,1H3,(H,17,19)