3-[4-[(E)-3-(1,3-benzodioxol-4-yl)prop-2-enoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[(E)-3-(1,3-benzodioxol-4-yl)prop-2-enoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[4-[(E)-3-(1,3-benzodioxol-4-yl)allyloxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[4-[(E)-3-(1,3-benzodioxol-4-yl)prop-2-enoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[(E)-3-(1,3-benzodioxol-4-yl)prop-2-enoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[4-[(E)-3-(1,3-benzodioxol-4-yl)allyloxy]phenyl]-2-ethoxy-propionic acid Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC=CC2=C3C(=CC=C2)OCO3)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OC/C=C/C2=C3C(=CC=C2)OCO3)C(=O)O

InChI

InChI=1S/C21H22O6/c1-2-24-19(21(22)23)13-15-8-10-17(11-9-15)25-12-4-6-16-5-3-7-18-20(16)27-14-26-18/h3-11,19H,2,12-14H2,1H3,(H,22,23)/b6-4+