(Z)-3-(3-bromanyl-4-butoxy-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-(3-bromanyl-4-butoxy-phenyl)-2-cyano-prop-2-enoate Openeye Name: (Z)-3-(3-bromo-4-butoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (Z)-3-(3-bromo-4-butoxyphenyl)-2-cyano-2-propenoate IUPAC Name: (Z)-3-(3-bromo-4-butoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (Z)-3-(3-bromo-4-butoxy-phenyl)-2-cyano-acrylate Formula: C14H13BrNO3- MolecularWeight: 323.16192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)[O-])Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(/C#N)\C(=O)[O-])Br

InChI

InChI=1S/C14H14BrNO3/c1-2-3-6-19-13-5-4-10(8-12(13)15)7-11(9-16)14(17)18/h4-5,7-8H,2-3,6H2,1H3,(H,17,18)/p-1/b11-7-