1-methyl-4-(phenylmethyl)-1,2,4-triazol-4-ium

Systemtic Name: 1-methyl-4-(phenylmethyl)-1,2,4-triazol-4-ium Openeye Name: 4-benzyl-1-methyl-1,2,4-triazol-4-ium CAS Name: 1-methyl-4-(phenylmethyl)-1,2,4-triazol-4-ium IUPAC Name: 4-benzyl-1-methyl-1,2,4-triazol-4-ium Traditional Name: 4-benzyl-1-methyl-1,2,4-triazol-4-ium Formula: C10H12N3+ MolecularWeight: 174.22238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C=N1)CC2=CC=CC=C2

Isomeric SMILES

CN1C=[N+](C=N1)CC2=CC=CC=C2

InChI

InChI=1S/C10H12N3/c1-12-9-13(8-11-12)7-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3/q+1