2-[(E)-3-(3-bromanyl-4,6-dimethoxy-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 2-[(E)-3-(3-bromanyl-4,6-dimethoxy-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 2-[(E)-3-(3-bromo-2-hydroxy-4,6-dimethoxy-phenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 2-[(E)-3-(3-bromo-2-hydroxy-4,6-dimethoxyphenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 2-[(E)-3-(3-bromo-2-hydroxy-4,6-dimethoxyphenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 2-[(E)-3-(3-bromo-2-hydroxy-4,6-dimethoxy-phenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C18H15BrO6 MolecularWeight: 407.2121

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1C(=O)C=CC2=CC=CC=C2C(=O)O)O)Br)OC

Isomeric SMILES

COC1=CC(=C(C(=C1C(=O)/C=C/C2=CC=CC=C2C(=O)O)O)Br)OC

InChI

InChI=1S/C18H15BrO6/c1-24-13-9-14(25-2)16(19)17(21)15(13)12(20)8-7-10-5-3-4-6-11(10)18(22)23/h3-9,21H,1-2H3,(H,22,23)/b8-7+