(E)-3-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(3-chloro-5-methoxy-4-propargyloxy-phenyl)-2-cyano-acrylic acid Formula: C14H10ClNO4 MolecularWeight: 291.6865

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)O)Cl)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)O)Cl)OCC#C

InChI

InChI=1S/C14H10ClNO4/c1-3-4-20-13-11(15)6-9(7-12(13)19-2)5-10(8-16)14(17)18/h1,5-7H,4H2,2H3,(H,17,18)/b10-5+