ethyl 3-[4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl 3-[4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl 3-[4-[2-(2-bromo-4-methyl-anilino)-2-oxo-ethoxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: 3-[4-[2-(2-bromo-4-methylanilino)-2-oxoethoxy]-3-ethoxyphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-(2-bromo-4-methylanilino)-2-oxoethoxy]-3-ethoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: 3-[4-[2-(2-bromo-4-methyl-anilino)-2-keto-ethoxy]-3-ethoxy-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C23H23BrN2O5 MolecularWeight: 487.34312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCC)OCC(=O)NC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCC)OCC(=O)NC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C23H23BrN2O5/c1-4-29-21-12-16(11-17(13-25)23(28)30-5-2)7-9-20(21)31-14-22(27)26-19-8-6-15(3)10-18(19)24/h6-12H,4-5,14H2,1-3H3,(H,26,27)