1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2H-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2H-1,2,3,4-tetrazol-5-one Openeye Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2H-tetrazol-5-one CAS Name: 1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2H-tetrazol-5-one IUPAC Name: 1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2H-tetrazol-5-one Traditional Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2H-tetrazol-5-one Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)N3C(=O)N=NN3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)N3C(=O)N=NN3

InChI

InChI=1S/C14H15N5O/c1-10-8-13(19-14(20)15-16-17-19)11(2)18(10)9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3,(H,15,17,20)