(5S,6S)-4-methylidene-5-nitro-6-(3-nitrophenyl)-1,3-diazinan-2-one

Systemtic Name: (5S,6S)-4-methylidene-5-nitro-6-(3-nitrophenyl)-1,3-diazinan-2-one Openeye Name: (5S,6S)-4-methylene-5-nitro-6-(3-nitrophenyl)hexahydropyrimidin-2-one CAS Name: (5S,6S)-4-methylene-5-nitro-6-(3-nitrophenyl)-1,3-diazinan-2-one IUPAC Name: (5S,6S)-4-methylidene-5-nitro-6-(3-nitrophenyl)-1,3-diazinan-2-one Traditional Name: (5S,6S)-4-methylene-5-nitro-6-(3-nitrophenyl)hexahydropyrimidin-2-one Formula: C11H10N4O5 MolecularWeight: 278.2209

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=O)N1)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C=C1[C@H]([C@@H](NC(=O)N1)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O5/c1-6-10(15(19)20)9(13-11(16)12-6)7-3-2-4-8(5-7)14(17)18/h2-5,9-10H,1H2,(H2,12,13,16)/t9-,10+/m0/s1