3-[3-[(4-ethoxycarbonyl-2-methoxy-phenoxy)methyl]-4-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: 3-[3-[(4-ethoxycarbonyl-2-methoxy-phenoxy)methyl]-4-methoxy-phenyl]prop-2-enoic acid Openeye Name: 3-[3-[(4-ethoxycarbonyl-2-methoxy-phenoxy)methyl]-4-methoxy-phenyl]prop-2-enoic acid CAS Name: 3-[3-[(4-ethoxycarbonyl-2-methoxyphenoxy)methyl]-4-methoxyphenyl]-2-propenoic acid IUPAC Name: 3-[3-[(4-ethoxycarbonyl-2-methoxyphenoxy)methyl]-4-methoxyphenyl]prop-2-enoic acid Traditional Name: 3-[3-[(4-carbethoxy-2-methoxy-phenoxy)methyl]-4-methoxy-phenyl]acrylic acid Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OCC2=C(C=CC(=C2)C=CC(=O)O)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OCC2=C(C=CC(=C2)C=CC(=O)O)OC)OC

InChI

InChI=1S/C21H22O7/c1-4-27-21(24)15-7-9-18(19(12-15)26-3)28-13-16-11-14(6-10-20(22)23)5-8-17(16)25-2/h5-12H,4,13H2,1-3H3,(H,22,23)