2-(4-methylphenyl)-4-(4-nitrophenyl)-1,3,4-oxadiazin-5-one

Systemtic Name: 2-(4-methylphenyl)-4-(4-nitrophenyl)-1,3,4-oxadiazin-5-one Openeye Name: 4-(4-nitrophenyl)-2-(p-tolyl)-1,3,4-oxadiazin-5-one CAS Name: 2-(4-methylphenyl)-4-(4-nitrophenyl)-1,3,4-oxadiazin-5-one IUPAC Name: 2-(4-methylphenyl)-4-(4-nitrophenyl)-1,3,4-oxadiazin-5-one Traditional Name: 4-(4-nitrophenyl)-2-(p-tolyl)-1,3,4-oxadiazin-5-one Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)CO2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)CO2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c1-11-2-4-12(5-3-11)16-17-18(15(20)10-23-16)13-6-8-14(9-7-13)19(21)22/h2-9H,10H2,1H3