3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(4-butylphenyl)propanamide

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(4-butylphenyl)propanamide Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(4-butylphenyl)propanamide CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(4-butylphenyl)propanamide IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(4-butylphenyl)propanamide Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(4-butylphenyl)propionamide Formula: C21H26BrNO3 MolecularWeight: 420.34004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C21H26BrNO3/c1-4-5-6-15-7-10-17(11-8-15)23-21(24)12-9-16-13-19(25-2)20(26-3)14-18(16)22/h7-8,10-11,13-14H,4-6,9,12H2,1-3H3,(H,23,24)