(5-bromanyl-2-methoxy-phenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-ethoxyphenyl)-2-propenoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-phenetyl-acrylic acid (5-bromo-2-methoxy-benzyl) ester Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO4/c1-3-25-18-7-4-14(5-8-18)10-15(12-22)20(23)26-13-16-11-17(21)6-9-19(16)24-2/h4-11H,3,13H2,1-2H3/b15-10+