5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium

Systemtic Name: 5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium Openeye Name: 5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium CAS Name: 5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium IUPAC Name: 5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium Traditional Name: 5,5-dimethyl-3-phenyl-1,2-dihydro-1,2,4-triazol-1-ium Formula: C10H14N3+ MolecularWeight: 176.23826

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Descriptors Computed from Structure

Canonical SMILES:

CC1([NH2+]NC(=N1)C2=CC=CC=C2)C

Isomeric SMILES

CC1([NH2+]NC(=N1)C2=CC=CC=C2)C

InChI

InChI=1S/C10H13N3/c1-10(2)11-9(12-13-10)8-6-4-3-5-7-8/h3-7,13H,1-2H3,(H,11,12)/p+1