5-butyl-1-phenyl-1,2-diazinan-3-one

Systemtic Name: 5-butyl-1-phenyl-1,2-diazinan-3-one Openeye Name: 5-butyl-1-phenyl-hexahydropyridazin-3-one CAS Name: 5-butyl-1-phenyl-3-diazinanone IUPAC Name: 5-butyl-1-phenyldiazinan-3-one Traditional Name: 5-butyl-1-phenyl-hexahydropyridazin-3-one Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=O)NN(C1)C2=CC=CC=C2

Isomeric SMILES

CCCCC1CC(=O)NN(C1)C2=CC=CC=C2

InChI

InChI=1S/C14H20N2O/c1-2-3-7-12-10-14(17)15-16(11-12)13-8-5-4-6-9-13/h4-6,8-9,12H,2-3,7,10-11H2,1H3,(H,15,17)