(E)-1-(azepan-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Formula: C16H21NO2 MolecularWeight: 259.34344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N2CCCCCC2

InChI

InChI=1S/C16H21NO2/c1-19-15-9-6-14(7-10-15)8-11-16(18)17-12-4-2-3-5-13-17/h6-11H,2-5,12-13H2,1H3/b11-8+