1-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-phenyl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-phenyltetrazol-5-one Traditional Name: 1-[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-phenyl-tetrazol-5-one Formula: C16H17N5O2 MolecularWeight: 311.33848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H17N5O2/c1-11-9-14(12(2)19(11)3)15(22)10-20-16(23)21(18-17-20)13-7-5-4-6-8-13/h4-9H,10H2,1-3H3