(E)-3-[2-bromanyl-4-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-bromanyl-4-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[2-bromo-4-[2-(4-ethoxycarbonylanilino)-2-oxo-ethoxy]-5-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[2-bromo-4-[2-(4-ethoxycarbonylanilino)-2-oxoethoxy]-5-methoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[2-bromo-4-[2-(4-ethoxycarbonylanilino)-2-oxoethoxy]-5-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[2-bromo-4-[2-(4-carbethoxyanilino)-2-keto-ethoxy]-5-methoxy-phenyl]acrylate Formula: C21H19BrNO7- MolecularWeight: 477.28206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C(=C2)Br)C=CC(=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C(=C2)Br)/C=C/C(=O)[O-])OC

InChI

InChI=1S/C21H20BrNO7/c1-3-29-21(27)13-4-7-15(8-5-13)23-19(24)12-30-18-11-16(22)14(6-9-20(25)26)10-17(18)28-2/h4-11H,3,12H2,1-2H3,(H,23,24)(H,25,26)/p-1/b9-6+