1-(5-ethanoyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone

Systemtic Name: 1-(5-ethanoyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Openeye Name: 1-(5-acetyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone CAS Name: 1-(5-acetyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone IUPAC Name: 1-(5-acetyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Traditional Name: 1-(5-acetyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Formula: C21H18N3O2+ MolecularWeight: 344.38652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2NN(C=[N+]2C(=C1C3=CC=CC=C3)C(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C2NN(C=[N+]2C(=C1C3=CC=CC=C3)C(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2/c1-14(25)18-19(16-9-5-3-6-10-16)20(15(2)26)23-13-24(22-21(18)23)17-11-7-4-8-12-17/h3-13H,1-2H3/p+1