5-hexan-2-yl-2,6-dimethyl-1,3-diazinan-4-one; N-[(E)-(4-nitrophenyl)methylideneamino]methanamide

Systemtic Name: 5-hexan-2-yl-2,6-dimethyl-1,3-diazinan-4-one; N-[(E)-(4-nitrophenyl)methylideneamino]methanamide Openeye Name: 2,6-dimethyl-5-(1-methylpentyl)hexahydropyrimidin-4-one; N-[(E)-(4-nitrophenyl)methyleneamino]formamide CAS Name: 5-hexan-2-yl-2,6-dimethyl-1,3-diazinan-4-one; N-[(E)-(4-nitrophenyl)methylideneamino]formamide IUPAC Name: 5-hexan-2-yl-2,6-dimethyl-1,3-diazinan-4-one; N-[(E)-(4-nitrophenyl)methylideneamino]formamide Traditional Name: 2,6-dimethyl-5-(1-methylpentyl)hexahydropyrimidin-4-one; N-[(E)-(4-nitrobenzylidene)amino]formamide Formula: C20H31N5O4 MolecularWeight: 405.49124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1C(NC(NC1=O)C)C.C1=CC(=CC=C1C=NNC=O)[N+](=O)[O-]

Isomeric SMILES

CCCCC(C)C1C(NC(NC1=O)C)C.C1=CC(=CC=C1/C=N/NC=O)[N+](=O)[O-]

InChI

InChI=1S/C12H24N2O.C8H7N3O3/c1-5-6-7-8(2)11-9(3)13-10(4)14-12(11)15;12-6-10-9-5-7-1-3-8(4-2-7)11(13)14/h8-11,13H,5-7H2,1-4H3,(H,14,15);1-6H,(H,10,12)/b;9-5+