(Z)-1-(azepan-1-yl)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-prop-2-en-1-one

Systemtic Name: (Z)-1-(azepan-1-yl)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-prop-2-en-1-one Openeye Name: (Z)-1-(azepan-1-yl)-2-(5-methyltetrazol-1-yl)-3-phenyl-prop-2-en-1-one CAS Name: (Z)-1-(1-azepanyl)-2-(5-methyl-1-tetrazolyl)-3-phenyl-2-propen-1-one IUPAC Name: (Z)-1-(azepan-1-yl)-2-(5-methyltetrazol-1-yl)-3-phenylprop-2-en-1-one Traditional Name: (Z)-1-(azepan-1-yl)-2-(5-methyltetrazol-1-yl)-3-phenyl-prop-2-en-1-one Formula: C17H21N5O MolecularWeight: 311.38154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=NN1C(=CC2=CC=CC=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=NN=NN1/C(=C\C2=CC=CC=C2)/C(=O)N3CCCCCC3

InChI

InChI=1S/C17H21N5O/c1-14-18-19-20-22(14)16(13-15-9-5-4-6-10-15)17(23)21-11-7-2-3-8-12-21/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3/b16-13-