2-(3-chloranyl-4-methyl-phenyl)-3-oxidanidyl-1H-1,2,3-triazol-3-ium-5-one

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-3-oxidanidyl-1H-1,2,3-triazol-3-ium-5-one Openeye Name: 2-(3-chloro-4-methyl-phenyl)-3-oxido-1H-triazol-3-ium-5-one CAS Name: 2-(3-chloro-4-methylphenyl)-3-oxido-1H-triazol-3-ium-5-one IUPAC Name: 2-(3-chloro-4-methylphenyl)-3-oxido-1H-triazol-3-ium-5-one Traditional Name: 2-(3-chloro-4-methyl-phenyl)-3-oxido-1H-triazol-3-ium-5-one Formula: C9H8ClN3O2 MolecularWeight: 225.63172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2NC(=O)C=[N+]2[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2NC(=O)C=[N+]2[O-])Cl

InChI

InChI=1S/C9H8ClN3O2/c1-6-2-3-7(4-8(6)10)13-11-9(14)5-12(13)15/h2-5H,1H3,(H,11,14)