methyl (E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-benzoxy-3-bromo-5-ethoxy-phenyl)-2-cyano-acrylic acid methyl ester Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)OC)Br)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)OC)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C20H18BrNO4/c1-3-25-18-11-15(9-16(12-22)20(23)24-2)10-17(21)19(18)26-13-14-7-5-4-6-8-14/h4-11H,3,13H2,1-2H3/b16-9+