methyl (E)-3-[5-(hydroxymethyl)-3-methanoyl-4-methoxy-6-oxidanylidene-pyran-2-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[5-(hydroxymethyl)-3-methanoyl-4-methoxy-6-oxidanylidene-pyran-2-yl]prop-2-enoate Openeye Name: methyl (E)-3-[3-formyl-5-(hydroxymethyl)-4-methoxy-6-oxo-pyran-2-yl]prop-2-enoate CAS Name: (E)-3-[3-formyl-5-(hydroxymethyl)-4-methoxy-6-oxo-2-pyranyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-formyl-5-(hydroxymethyl)-4-methoxy-6-oxopyran-2-yl]prop-2-enoate Traditional Name: (E)-3-(3-formyl-6-keto-4-methoxy-5-methylol-pyran-2-yl)acrylic acid methyl ester Formula: C12H12O7 MolecularWeight: 268.21948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)OC(=C1C=O)C=CC(=O)OC)CO

Isomeric SMILES

COC1=C(C(=O)OC(=C1C=O)/C=C/C(=O)OC)CO

InChI

InChI=1S/C12H12O7/c1-17-10(15)4-3-9-7(5-13)11(18-2)8(6-14)12(16)19-9/h3-5,14H,6H2,1-2H3/b4-3+