(E)-1-(azepan-1-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(4-ethoxy-3-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(4-ethoxy-3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-en-1-one Formula: C18H25NO3 MolecularWeight: 303.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)N2CCCCCC2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCCCCC2)OC

InChI

InChI=1S/C18H25NO3/c1-3-22-16-10-8-15(14-17(16)21-2)9-11-18(20)19-12-6-4-5-7-13-19/h8-11,14H,3-7,12-13H2,1-2H3/b11-9+