1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium

Systemtic Name: 1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium Openeye Name: 1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium CAS Name: 1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium IUPAC Name: 1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium Traditional Name: 1-phenyl-4-[(1R)-1-phenylethyl]-1,2,4-triazol-4-ium Formula: C16H16N3+ MolecularWeight: 250.31834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[N+]2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H16N3/c1-14(15-8-4-2-5-9-15)18-12-17-19(13-18)16-10-6-3-7-11-16/h2-14H,1H3/q+1/t14-/m1/s1