2-[5-bromanyl-2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid

Systemtic Name: 2-[5-bromanyl-2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoic acid Openeye Name: 2-[5-bromo-2-methoxy-4-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenoxy]acetic acid CAS Name: 2-[5-bromo-2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenoxy]acetic acid IUPAC Name: 2-[5-bromo-2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenoxy]acetic acid Traditional Name: 2-[5-bromo-4-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-methoxy-phenoxy]acetic acid Formula: C13H13BrO6 MolecularWeight: 345.14272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrO6/c1-18-10-5-8(3-4-13(17)19-2)9(14)6-11(10)20-7-12(15)16/h3-6H,7H2,1-2H3,(H,15,16)/b4-3+