2-[5-bromanyl-2-methoxy-4-[(1-oxidanylbutan-2-ylamino)methyl]phenoxy]-N-phenethyl-ethanamide

Systemtic Name: 2-[5-bromanyl-2-methoxy-4-[(1-oxidanylbutan-2-ylamino)methyl]phenoxy]-N-phenethyl-ethanamide Openeye Name: 2-[5-bromo-4-[[1-(hydroxymethyl)propylamino]methyl]-2-methoxy-phenoxy]-N-phenethyl-acetamide CAS Name: 2-[5-bromo-4-[(1-hydroxybutan-2-ylamino)methyl]-2-methoxyphenoxy]-N-phenethylacetamide IUPAC Name: 2-[5-bromo-4-[(1-hydroxybutan-2-ylamino)methyl]-2-methoxyphenoxy]-N-phenethylacetamide Traditional Name: 2-[5-bromo-2-methoxy-4-[(1-methylolpropylamino)methyl]phenoxy]-N-phenethyl-acetamide Formula: C22H29BrN2O4 MolecularWeight: 465.38066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=CC(=C(C=C1Br)OCC(=O)NCCC2=CC=CC=C2)OC

Isomeric SMILES

CCC(CO)NCC1=CC(=C(C=C1Br)OCC(=O)NCCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H29BrN2O4/c1-3-18(14-26)25-13-17-11-20(28-2)21(12-19(17)23)29-15-22(27)24-10-9-16-7-5-4-6-8-16/h4-8,11-12,18,25-26H,3,9-10,13-15H2,1-2H3,(H,24,27)