2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid

Systemtic Name: 2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Openeye Name: 2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid CAS Name: 2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid IUPAC Name: 2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Traditional Name: 2-(3-bromophenyl)-3-(carboxymethyl)-1H-indole-5-carboxylic acid Formula: C17H12BrNO4 MolecularWeight: 374.18548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO4/c18-11-3-1-2-9(6-11)16-13(8-15(20)21)12-7-10(17(22)23)4-5-14(12)19-16/h1-7,19H,8H2,(H,20,21)(H,22,23)