2-(4-azanyl-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenyl-ethanamide

Systemtic Name: 2-(4-azanyl-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenyl-ethanamide Openeye Name: 2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenyl-acetamide CAS Name: 2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenylacetamide IUPAC Name: 2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenylacetamide Traditional Name: 2-(4-amino-3,5-dimethyl-1,2,4-triazol-4-ium-1-yl)-N-phenyl-acetamide Formula: C12H16N5O+ MolecularWeight: 246.28834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=[N+]1N)C)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=[N+]1N)C)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H15N5O/c1-9-15-16(10(2)17(9)13)8-12(18)14-11-6-4-3-5-7-11/h3-7H,8,13H2,1-2H3/p+1