[5-methyl-2-(4-nitrophenyl)-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone

Systemtic Name: [5-methyl-2-(4-nitrophenyl)-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone Openeye Name: [5-methyl-2-(4-nitrophenyl)-3-oxido-triazol-3-ium-4-yl]-phenyl-methanone CAS Name: [5-methyl-2-(4-nitrophenyl)-3-oxido-4-triazol-3-iumyl]-phenylmethanone IUPAC Name: [5-methyl-2-(4-nitrophenyl)-3-oxidotriazol-3-ium-4-yl]-phenylmethanone Traditional Name: [5-methyl-2-(4-nitrophenyl)-3-oxido-triazol-3-ium-4-yl]-phenyl-methanone Formula: C16H12N4O4 MolecularWeight: 324.29088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN([N+](=C1C(=O)C2=CC=CC=C2)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN([N+](=C1C(=O)C2=CC=CC=C2)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4/c1-11-15(16(21)12-5-3-2-4-6-12)19(22)18(17-11)13-7-9-14(10-8-13)20(23)24/h2-10H,1H3