N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide CAS Name: N-[2-(1-azepanyl)-5-chlorophenyl]-2-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-chlorophenyl]-2-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide Formula: C23H29ClN2O4 MolecularWeight: 432.94036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)NC2=C(C=CC(=C2)Cl)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)NC2=C(C=CC(=C2)Cl)N3CCCCCC3

InChI

InChI=1S/C23H29ClN2O4/c1-28-20-12-16(13-21(29-2)23(20)30-3)14-22(27)25-18-15-17(24)8-9-19(18)26-10-6-4-5-7-11-26/h8-9,12-13,15H,4-7,10-11,14H2,1-3H3,(H,25,27)