2-[4-[(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)prop-2-enoyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)acryloyl]-2-methoxy-phenoxy]acetic acid Formula: C22H21BrO7 MolecularWeight: 477.30194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C=CC2=CC(=C(C(=C2)Br)OCC=C)OC)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)/C=C/C2=CC(=C(C(=C2)Br)OCC=C)OC)OCC(=O)O

InChI

InChI=1S/C22H21BrO7/c1-4-9-29-22-16(23)10-14(11-20(22)28-3)5-7-17(24)15-6-8-18(19(12-15)27-2)30-13-21(25)26/h4-8,10-12H,1,9,13H2,2-3H3,(H,25,26)/b7-5+