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

Systemtic Name: 2-[4-[(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)prop-2-enoyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)acryloyl]-2-methoxy-phenoxy]acetic acid Formula: C21H21BrO7 MolecularWeight: 465.29124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)C2=CC(=C(C=C2)OCC(=O)O)OC)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC(=C(C=C2)OCC(=O)O)OC)Br)OC

InChI

InChI=1S/C21H21BrO7/c1-4-28-19-10-13(9-15(22)21(19)27-3)5-7-16(23)14-6-8-17(18(11-14)26-2)29-12-20(24)25/h5-11H,4,12H2,1-3H3,(H,24,25)/b7-5+