N-[2-(azepan-1-ylcarbonyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-3-(3,4-dimethoxyphenyl)propanamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(3,4-dimethoxyphenyl)propionamide Formula: C24H30N2O4 MolecularWeight: 410.506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)OC

InChI

InChI=1S/C24H30N2O4/c1-29-21-13-11-18(17-22(21)30-2)12-14-23(27)25-20-10-6-5-9-19(20)24(28)26-15-7-3-4-8-16-26/h5-6,9-11,13,17H,3-4,7-8,12,14-16H2,1-2H3,(H,25,27)