4-(4-chloranyl-2-methyl-phenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-dione

Systemtic Name: 4-(4-chloranyl-2-methyl-phenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-dione Openeye Name: 4-(4-chloro-2-methyl-phenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-dione CAS Name: 4-(4-chloro-2-methylphenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-dione IUPAC Name: 4-(4-chloro-2-methylphenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-dione Traditional Name: 4-(4-chloro-2-methyl-phenyl)-1,1-dimethyl-1,2,4-triazolidin-1-ium-3,5-quinone Formula: C11H13ClN3O2+ MolecularWeight: 254.69282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2C(=O)N[N+](C2=O)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2C(=O)N[N+](C2=O)(C)C

InChI

InChI=1S/C11H12ClN3O2/c1-7-6-8(12)4-5-9(7)14-10(16)13-15(2,3)11(14)17/h4-6H,1-3H3/p+1