1-(5-ethanoyl-2-phenyl-3H-pyrrolo[2,1-e][1,2,3,4]tetrazol-4-ium-7-yl)ethanone

Systemtic Name: 1-(5-ethanoyl-2-phenyl-3H-pyrrolo[2,1-e][1,2,3,4]tetrazol-4-ium-7-yl)ethanone Openeye Name: 1-(5-acetyl-2-phenyl-3H-pyrrolo[2,1-e]tetrazol-4-ium-7-yl)ethanone CAS Name: 1-(5-acetyl-2-phenyl-3H-pyrrolo[2,1-e]tetrazol-4-ium-7-yl)ethanone IUPAC Name: 1-(5-acetyl-2-phenyl-3H-pyrrolo[2,1-e]tetrazol-4-ium-7-yl)ethanone Traditional Name: 1-(5-acetyl-2-phenyl-3H-pyrrolo[2,1-e]tetrazol-4-ium-7-yl)ethanone Formula: C14H13N4O2+ MolecularWeight: 269.27862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=[N+]2C1=NN(N2)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(=O)C1=CC(=[N+]2C1=NN(N2)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C14H12N4O2/c1-9(19)12-8-13(10(2)20)17-14(12)15-18(16-17)11-6-4-3-5-7-11/h3-8H,1-2H3/p+1