N-[1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,2,4-triazol-4-ium-4-yl]benzamide

Systemtic Name: N-[1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,2,4-triazol-4-ium-4-yl]benzamide Openeye Name: N-[1-[2-(4-chlorophenyl)-2-oxo-ethyl]-1,2,4-triazol-4-ium-4-yl]benzamide CAS Name: N-[1-[2-(4-chlorophenyl)-2-oxoethyl]-1,2,4-triazol-4-ium-4-yl]benzamide IUPAC Name: N-[1-[2-(4-chlorophenyl)-2-oxoethyl]-1,2,4-triazol-4-ium-4-yl]benzamide Traditional Name: N-[1-[2-(4-chlorophenyl)-2-keto-ethyl]-1,2,4-triazol-4-ium-4-yl]benzamide Formula: C17H14ClN4O2+ MolecularWeight: 341.77166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O2/c18-15-8-6-13(7-9-15)16(23)10-21-12-22(11-19-21)20-17(24)14-4-2-1-3-5-14/h1-9,11-12H,10H2/p+1