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

Systemtic Name: 2-[4-[(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)prop-2-enoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)prop-2-enoyl]phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)prop-2-enoyl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)acryloyl]phenoxy]acetic acid Formula: C18H15BrO6 MolecularWeight: 407.2121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrO6/c1-24-17-9-14(19)12(8-16(17)21)4-7-15(20)11-2-5-13(6-3-11)25-10-18(22)23/h2-9,21H,10H2,1H3,(H,22,23)/b7-4+