methyl (E)-3-(2-acetyloxy-3-methoxy-4-oxidanyl-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(2-acetyloxy-3-methoxy-4-oxidanyl-phenyl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(2-acetoxy-4-hydroxy-3-methoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-acetyloxy-4-hydroxy-3-methoxyphenyl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-acetyloxy-4-hydroxy-3-methoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(2-acetoxy-4-hydroxy-3-methoxy-phenyl)-2-cyano-acrylic acid methyl ester Formula: C14H13NO6 MolecularWeight: 291.25612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1OC)O)C=C(C#N)C(=O)OC

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1OC)O)/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C14H13NO6/c1-8(16)21-12-9(4-5-11(17)13(12)19-2)6-10(7-15)14(18)20-3/h4-6,17H,1-3H3/b10-6+