5-bromanyl-3-(carboxymethyl)indole-1-carboxylic acid

Systemtic Name: 5-bromanyl-3-(carboxymethyl)indole-1-carboxylic acid Openeye Name: 5-bromo-3-(carboxymethyl)indole-1-carboxylic acid CAS Name: 5-bromo-3-(carboxymethyl)-1-indolecarboxylic acid IUPAC Name: 5-bromo-3-(carboxymethyl)indole-1-carboxylic acid Traditional Name: 5-bromo-3-(carboxymethyl)indole-1-carboxylic acid Formula: C11H8BrNO4 MolecularWeight: 298.08952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CN2C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CN2C(=O)O)CC(=O)O

InChI

InChI=1S/C11H8BrNO4/c12-7-1-2-9-8(4-7)6(3-10(14)15)5-13(9)11(16)17/h1-2,4-5H,3H2,(H,14,15)(H,16,17)