6-methyl-2-[(4-nitrophenyl)amino]-5-pentyl-1,3-diazinan-4-one

Systemtic Name: 6-methyl-2-[(4-nitrophenyl)amino]-5-pentyl-1,3-diazinan-4-one Openeye Name: 6-methyl-2-(4-nitroanilino)-5-pentyl-hexahydropyrimidin-4-one CAS Name: 6-methyl-2-(4-nitroanilino)-5-pentyl-1,3-diazinan-4-one IUPAC Name: 6-methyl-2-(4-nitroanilino)-5-pentyl-1,3-diazinan-4-one Traditional Name: 5-amyl-6-methyl-2-(4-nitroanilino)hexahydropyrimidin-4-one Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(NC(NC1=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCCCC1C(NC(NC1=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H24N4O3/c1-3-4-5-6-14-11(2)17-16(19-15(14)21)18-12-7-9-13(10-8-12)20(22)23/h7-11,14,16-18H,3-6H2,1-2H3,(H,19,21)