butyl 4-[3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: butyl 4-[3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: butyl 4-[3-(5-bromo-2-ethoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(5-bromo-2-ethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[3-(5-bromo-2-ethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(5-bromo-2-ethoxy-phenyl)acryloyl]amino]benzoic acid butyl ester Formula: C22H24BrNO4 MolecularWeight: 446.33426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C22H24BrNO4/c1-3-5-14-28-22(26)16-6-10-19(11-7-16)24-21(25)13-8-17-15-18(23)9-12-20(17)27-4-2/h6-13,15H,3-5,14H2,1-2H3,(H,24,25)