5-[[3-(carboxymethyl)-5-chloranyl-1H-indol-2-yl]carbonyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-[[3-(carboxymethyl)-5-chloranyl-1H-indol-2-yl]carbonyl]-1,2-oxazole-3-carboxylic acid Openeye Name: 5-[3-(carboxymethyl)-5-chloro-1H-indole-2-carbonyl]isoxazole-3-carboxylic acid CAS Name: 5-[[3-(carboxymethyl)-5-chloro-1H-indol-2-yl]-oxomethyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-[3-(carboxymethyl)-5-chloro-1H-indole-2-carbonyl]-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[3-(carboxymethyl)-5-chloro-1H-indole-2-carbonyl]isoxazole-3-carboxylic acid Formula: C15H9ClN2O6 MolecularWeight: 348.69476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=C(N2)C(=O)C3=CC(=NO3)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=C(N2)C(=O)C3=CC(=NO3)C(=O)O)CC(=O)O

InChI

InChI=1S/C15H9ClN2O6/c16-6-1-2-9-7(3-6)8(4-12(19)20)13(17-9)14(21)11-5-10(15(22)23)18-24-11/h1-3,5,17H,4H2,(H,19,20)(H,22,23)