(E)-2-cyano-3-(4-cyclopropylcarbonyloxy-3-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(4-cyclopropylcarbonyloxy-3-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[4-[cyclopropyl(oxo)methoxy]-3-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxy-phenyl]acrylic acid Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)O)OC(=O)C2CC2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)O)OC(=O)C2CC2

InChI

InChI=1S/C15H13NO5/c1-20-13-7-9(6-11(8-16)14(17)18)2-5-12(13)21-15(19)10-3-4-10/h2,5-7,10H,3-4H2,1H3,(H,17,18)/b11-6+