4,6-bis(chloranyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-(2-hydroxy-1-methyl-2-oxo-ethyl)-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-(1-hydroxy-1-oxopropan-2-yl)-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-(1-hydroxy-1-oxopropan-2-yl)-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-(2-hydroxy-2-keto-1-methyl-ethyl)-1H-indole-2-carboxylic acid Formula: C12H9Cl2NO4 MolecularWeight: 302.11016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O)C(=O)O

Isomeric SMILES

CC(C1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C12H9Cl2NO4/c1-4(11(16)17)8-9-6(14)2-5(13)3-7(9)15-10(8)12(18)19/h2-4,15H,1H3,(H,16,17)(H,18,19)