1-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-4-phenyl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-phenyltetrazol-5-one Traditional Name: 1-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl]-4-phenyl-tetrazol-5-one Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2C(=O)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2C(=O)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N5O3/c1-10-15(12(3)23)11(2)18-16(10)14(24)9-21-17(25)22(20-19-21)13-7-5-4-6-8-13/h4-8,18H,9H2,1-3H3