2-(1-pentyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)ethanamide

Systemtic Name: 2-(1-pentyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)ethanamide Openeye Name: 2-(1-pentyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)acetamide CAS Name: 2-(1-pentyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)acetamide IUPAC Name: 2-(1-pentyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)acetamide Traditional Name: 2-(1-amyl-3-phenethyl-1,2,4-triazol-1-ium-1-yl)acetamide Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1(C=NC(=N1)CCC2=CC=CC=C2)CC(=O)N

Isomeric SMILES

CCCCC[N+]1(C=NC(=N1)CCC2=CC=CC=C2)CC(=O)N

InChI

InChI=1S/C17H24N4O/c1-2-3-7-12-21(13-16(18)22)14-19-17(20-21)11-10-15-8-5-4-6-9-15/h4-6,8-9,14H,2-3,7,10-13H2,1H3,(H-,18,22)/p+1