1-(azepan-1-yl)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(5-phenyltetrazol-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(5-phenyl-1-tetrazolyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(5-phenyltetrazol-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(5-phenyltetrazol-1-yl)ethanone Formula: C15H19N5O MolecularWeight: 285.34426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=NN=N2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=NN=N2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N5O/c21-14(19-10-6-1-2-7-11-19)12-20-15(16-17-18-20)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2