1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone

Systemtic Name: 1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Openeye Name: 1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone CAS Name: 1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone IUPAC Name: 1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Traditional Name: 1-(3-methyl-2,6-diphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-7-yl)ethanone Formula: C20H18N3O+ MolecularWeight: 316.37642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C=C(C(=C2NN1C3=CC=CC=C3)C(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=[N+]2C=C(C(=C2NN1C3=CC=CC=C3)C(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O/c1-14(24)19-18(16-9-5-3-6-10-16)13-22-15(2)23(21-20(19)22)17-11-7-4-8-12-17/h3-13H,1-2H3/p+1