4,7-bis(chloranyl)-2-(4-methylphenyl)-6-nitro-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 4,7-bis(chloranyl)-2-(4-methylphenyl)-6-nitro-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 4,7-dichloro-6-nitro-1-oxido-2-(p-tolyl)benzotriazol-1-ium CAS Name: 4,7-dichloro-2-(4-methylphenyl)-6-nitro-1-oxidobenzotriazol-1-ium IUPAC Name: 4,7-dichloro-2-(4-methylphenyl)-6-nitro-1-oxidobenzotriazol-1-ium Traditional Name: 4,7-dichloro-6-nitro-1-oxido-2-(p-tolyl)benzotriazol-1-ium Formula: C13H8Cl2N4O3 MolecularWeight: 339.13362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C(=CC(=C(C3=[N+]2[O-])Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C(=CC(=C(C3=[N+]2[O-])Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8Cl2N4O3/c1-7-2-4-8(5-3-7)17-16-12-9(14)6-10(19(21)22)11(15)13(12)18(17)20/h2-6H,1H3