2-(2-bromanyl-4,5-dimethoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Formula: C19H16BrNO6 MolecularWeight: 434.23744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CC(=O)O)Br)OC

InChI

InChI=1S/C19H16BrNO6/c1-26-15-6-12(13(20)8-16(15)27-2)18-11(7-17(22)23)10-5-9(19(24)25)3-4-14(10)21-18/h3-6,8,21H,7H2,1-2H3,(H,22,23)(H,24,25)