1-(1-methyl-6-phenyl-pyrrolo[2,1-e][1,2,3,4]tetrazol-5-yl)ethanone

Systemtic Name: 1-(1-methyl-6-phenyl-pyrrolo[2,1-e][1,2,3,4]tetrazol-5-yl)ethanone Openeye Name: 1-(1-methyl-6-phenyl-pyrrolo[2,1-e]tetrazol-5-yl)ethanone CAS Name: 1-(1-methyl-6-phenyl-5-pyrrolo[2,1-e]tetrazolyl)ethanone IUPAC Name: 1-(1-methyl-6-phenylpyrrolo[2,1-e]tetrazol-5-yl)ethanone Traditional Name: 1-(1-methyl-6-phenyl-pyrrolo[2,1-e]tetrazol-5-yl)ethanone Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C2N1N=NN2C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(C=C2N1N=NN2C)C3=CC=CC=C3

InChI

InChI=1S/C13H12N4O/c1-9(18)13-11(10-6-4-3-5-7-10)8-12-16(2)14-15-17(12)13/h3-8H,1-2H3