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

Systemtic Name: propan-2-yl 4-[3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(5-bromo-2-ethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(5-bromo-2-ethoxy-phenyl)acryloyl]amino]benzoic acid isopropyl ester Formula: C21H22BrNO4 MolecularWeight: 432.30768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C21H22BrNO4/c1-4-26-19-11-8-17(22)13-16(19)7-12-20(24)23-18-9-5-15(6-10-18)21(25)27-14(2)3/h5-14H,4H2,1-3H3,(H,23,24)