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

Systemtic Name: 4-(4-methoxyphenyl)-1-(phenylmethyl)-1,2,4-triazol-4-ium Openeye Name: 1-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-4-ium CAS Name: 4-(4-methoxyphenyl)-1-(phenylmethyl)-1,2,4-triazol-4-ium IUPAC Name: 1-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-4-ium Traditional Name: 1-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-4-ium Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C16H16N3O/c1-20-16-9-7-15(8-10-16)18-12-17-19(13-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3/q+1