3-ethoxy-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-ethoxy-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-ethoxy-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-3-oxo-propanoic acid CAS Name: 3-ethoxy-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-3-oxopropanoic acid IUPAC Name: 3-ethoxy-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-3-oxopropanoic acid Traditional Name: 3-ethoxy-3-keto-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]propionic acid Formula: C14H16O7 MolecularWeight: 296.27264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1OC)OCO2)C(=O)O

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1OC)OCO2)C(=O)O

InChI

InChI=1S/C14H16O7/c1-3-19-14(17)9(13(15)16)4-8-5-11-12(21-7-20-11)6-10(8)18-2/h5-6,9H,3-4,7H2,1-2H3,(H,15,16)