4-bromanyl-2-(2-carboxy-6-methoxy-phenyl)-3,5-dimethoxy-benzoic acid

Systemtic Name: 4-bromanyl-2-(2-carboxy-6-methoxy-phenyl)-3,5-dimethoxy-benzoic acid Openeye Name: 4-bromo-2-(2-carboxy-6-methoxy-phenyl)-3,5-dimethoxy-benzoic acid CAS Name: 4-bromo-2-(2-carboxy-6-methoxyphenyl)-3,5-dimethoxybenzoic acid IUPAC Name: 4-bromo-2-(2-carboxy-6-methoxyphenyl)-3,5-dimethoxybenzoic acid Traditional Name: 4-bromo-2-(2-carboxy-6-methoxy-phenyl)-3,5-dimethoxy-benzoic acid Formula: C17H15BrO7 MolecularWeight: 411.2008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C2=C(C(=C(C=C2C(=O)O)OC)Br)OC)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1C2=C(C(=C(C=C2C(=O)O)OC)Br)OC)C(=O)O

InChI

InChI=1S/C17H15BrO7/c1-23-10-6-4-5-8(16(19)20)12(10)13-9(17(21)22)7-11(24-2)14(18)15(13)25-3/h4-7H,1-3H3,(H,19,20)(H,21,22)