prop-2-enyl (E)-3-(3-bromanyl-4,5-diethoxy-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: prop-2-enyl (E)-3-(3-bromanyl-4,5-diethoxy-phenyl)-2-cyano-prop-2-enoate Openeye Name: allyl (E)-3-(3-bromo-4,5-diethoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(3-bromo-4,5-diethoxyphenyl)-2-cyano-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-3-(3-bromo-4,5-diethoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(3-bromo-4,5-diethoxy-phenyl)-2-cyano-acrylic acid allyl ester Formula: C17H18BrNO4 MolecularWeight: 380.23312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)OCC=C)Br)OCC

InChI

InChI=1S/C17H18BrNO4/c1-4-7-23-17(20)13(11-19)8-12-9-14(18)16(22-6-3)15(10-12)21-5-2/h4,8-10H,1,5-7H2,2-3H3/b13-8+