3-[4-[(E)-3-(3-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]propanoic acid

Systemtic Name: 3-[4-[(E)-3-(3-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]propanoic acid Openeye Name: 3-[4-[(E)-3-(3-bromo-4-methoxy-phenyl)-3-oxo-prop-1-enyl]phenoxy]propanoic acid CAS Name: 3-[4-[(E)-3-(3-bromo-4-methoxyphenyl)-3-oxoprop-1-enyl]phenoxy]propanoic acid IUPAC Name: 3-[4-[(E)-3-(3-bromo-4-methoxyphenyl)-3-oxoprop-1-enyl]phenoxy]propanoic acid Traditional Name: 3-[4-[(E)-3-(3-bromo-4-methoxy-phenyl)-3-keto-prop-1-enyl]phenoxy]propionic acid Formula: C19H17BrO5 MolecularWeight: 405.23928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OCCC(=O)O)Br

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrO5/c1-24-18-9-5-14(12-16(18)20)17(21)8-4-13-2-6-15(7-3-13)25-11-10-19(22)23/h2-9,12H,10-11H2,1H3,(H,22,23)/b8-4+