2-[3-bromanyl-6-(hydroxymethyl)-2,4-dimethoxy-phenyl]-3-methoxy-benzoic acid

Systemtic Name: 2-[3-bromanyl-6-(hydroxymethyl)-2,4-dimethoxy-phenyl]-3-methoxy-benzoic acid Openeye Name: 2-[3-bromo-6-(hydroxymethyl)-2,4-dimethoxy-phenyl]-3-methoxy-benzoic acid CAS Name: 2-[3-bromo-6-(hydroxymethyl)-2,4-dimethoxyphenyl]-3-methoxybenzoic acid IUPAC Name: 2-[3-bromo-6-(hydroxymethyl)-2,4-dimethoxyphenyl]-3-methoxybenzoic acid Traditional Name: 2-(3-bromo-2,4-dimethoxy-6-methylol-phenyl)-3-methoxy-benzoic acid Formula: C17H17BrO6 MolecularWeight: 397.21728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C2=C(C(=C(C=C2CO)OC)Br)OC)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1C2=C(C(=C(C=C2CO)OC)Br)OC)C(=O)O

InChI

InChI=1S/C17H17BrO6/c1-22-11-6-4-5-10(17(20)21)14(11)13-9(8-19)7-12(23-2)15(18)16(13)24-3/h4-7,19H,8H2,1-3H3,(H,20,21)