2-(carboxymethyl)-1-methyl-indole-3-carboxylic acid

Systemtic Name: 2-(carboxymethyl)-1-methyl-indole-3-carboxylic acid Openeye Name: 2-(carboxymethyl)-1-methyl-indole-3-carboxylic acid CAS Name: 2-(carboxymethyl)-1-methyl-3-indolecarboxylic acid IUPAC Name: 2-(carboxymethyl)-1-methylindole-3-carboxylic acid Traditional Name: 2-(carboxymethyl)-1-methyl-indole-3-carboxylic acid Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1CC(=O)O)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1CC(=O)O)C(=O)O

InChI

InChI=1S/C12H11NO4/c1-13-8-5-3-2-4-7(8)11(12(16)17)9(13)6-10(14)15/h2-5H,6H2,1H3,(H,14,15)(H,16,17)