3-bromanyl-4-hexoxy-N-[3-(2-methylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-[3-(2-methylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-hexoxy-N-[3-(2-methylpropanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-hexoxy-N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-hexoxy-N-[3-(2-methylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-hexoxy-N-[3-(isobutyrylamino)phenyl]benzamide Formula: C23H29BrN2O3 MolecularWeight: 461.39196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C)Br

InChI

InChI=1S/C23H29BrN2O3/c1-4-5-6-7-13-29-21-12-11-17(14-20(21)24)23(28)26-19-10-8-9-18(15-19)25-22(27)16(2)3/h8-12,14-16H,4-7,13H2,1-3H3,(H,25,27)(H,26,28)