N-[3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[1-(azepane-1-carbonyl)-2-(3,4-dimethoxyphenyl)vinyl]benzamide CAS Name: N-[3-(1-azepanyl)-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[1-(azepane-1-carbonyl)-2-(3,4-dimethoxyphenyl)vinyl]benzamide Formula: C24H28N2O4 MolecularWeight: 408.49012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H28N2O4/c1-29-21-13-12-18(17-22(21)30-2)16-20(24(28)26-14-8-3-4-9-15-26)25-23(27)19-10-6-5-7-11-19/h5-7,10-13,16-17H,3-4,8-9,14-15H2,1-2H3,(H,25,27)