5-bromanyl-2-[[2-methoxy-5-(3-oxidanyl-3-oxidanylidene-prop-1-enyl)phenyl]methoxy]benzoic acid

Systemtic Name: 5-bromanyl-2-[[2-methoxy-5-(3-oxidanyl-3-oxidanylidene-prop-1-enyl)phenyl]methoxy]benzoic acid Openeye Name: 5-bromo-2-[[5-(3-hydroxy-3-oxo-prop-1-enyl)-2-methoxy-phenyl]methoxy]benzoic acid CAS Name: 5-bromo-2-[[5-(3-hydroxy-3-oxoprop-1-enyl)-2-methoxyphenyl]methoxy]benzoic acid IUPAC Name: 5-bromo-2-[[5-(3-hydroxy-3-oxoprop-1-enyl)-2-methoxyphenyl]methoxy]benzoic acid Traditional Name: 5-bromo-2-[5-(3-hydroxy-3-keto-prop-1-enyl)-2-methoxy-benzyl]oxy-benzoic acid Formula: C18H15BrO6 MolecularWeight: 407.2121

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)COC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)O)COC2=C(C=C(C=C2)Br)C(=O)O

InChI

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