2-ethanoyl-4-ethoxycarbonyl-3-(4-methoxyphenyl)-5-oxidanylidene-hexanoic acid

Systemtic Name: 2-ethanoyl-4-ethoxycarbonyl-3-(4-methoxyphenyl)-5-oxidanylidene-hexanoic acid Openeye Name: 2-acetyl-4-ethoxycarbonyl-3-(4-methoxyphenyl)-5-oxo-hexanoic acid CAS Name: 2-acetyl-4-ethoxycarbonyl-3-(4-methoxyphenyl)-5-oxohexanoic acid IUPAC Name: 2-acetyl-4-ethoxycarbonyl-3-(4-methoxyphenyl)-5-oxohexanoic acid Traditional Name: 2-acetyl-4-carbethoxy-5-keto-3-(4-methoxyphenyl)hexanoic acid Formula: C18H22O7 MolecularWeight: 350.36308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)OC)C(C(=O)C)C(=O)O)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)OC)C(C(=O)C)C(=O)O)C(=O)C

InChI

InChI=1S/C18H22O7/c1-5-25-18(23)15(11(3)20)16(14(10(2)19)17(21)22)12-6-8-13(24-4)9-7-12/h6-9,14-16H,5H2,1-4H3,(H,21,22)