methyl (E)-3-[3-bromanyl-4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[3-bromanyl-4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[3-bromo-4-[2-(dimethylamino)-2-oxo-ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-bromo-4-[2-(dimethylamino)-2-oxoethoxy]-5-methoxyphenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-bromo-4-[2-(dimethylamino)-2-oxoethoxy]-5-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-bromo-4-[2-(dimethylamino)-2-keto-ethoxy]-5-methoxy-phenyl]-2-cyano-acrylic acid methyl ester Formula: C16H17BrN2O5 MolecularWeight: 397.22058

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC1=C(C=C(C=C1Br)C=C(C#N)C(=O)OC)OC

Isomeric SMILES

CN(C)C(=O)COC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)OC)OC

InChI

InChI=1S/C16H17BrN2O5/c1-19(2)14(20)9-24-15-12(17)6-10(7-13(15)22-3)5-11(8-18)16(21)23-4/h5-7H,9H2,1-4H3/b11-5+