(E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(3-ethoxy-4-propargyloxy-phenyl)acrylic acid Formula: C15H13NO4 MolecularWeight: 271.26802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO4/c1-3-7-20-13-6-5-11(9-14(13)19-4-2)8-12(10-16)15(17)18/h1,5-6,8-9H,4,7H2,2H3,(H,17,18)/b12-8+