6-chloranyl-3-(4-oxidanyl-4-oxidanylidene-butyl)-1H-indole-2-carboxylic acid

Systemtic Name: 6-chloranyl-3-(4-oxidanyl-4-oxidanylidene-butyl)-1H-indole-2-carboxylic acid Openeye Name: 6-chloro-3-(4-hydroxy-4-oxo-butyl)-1H-indole-2-carboxylic acid CAS Name: 6-chloro-3-(4-hydroxy-4-oxobutyl)-1H-indole-2-carboxylic acid IUPAC Name: 6-chloro-3-(4-hydroxy-4-oxobutyl)-1H-indole-2-carboxylic acid Traditional Name: 6-chloro-3-(4-hydroxy-4-keto-butyl)-1H-indole-2-carboxylic acid Formula: C13H12ClNO4 MolecularWeight: 281.69168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=C2CCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=C2CCCC(=O)O)C(=O)O

InChI

InChI=1S/C13H12ClNO4/c14-7-4-5-8-9(2-1-3-11(16)17)12(13(18)19)15-10(8)6-7/h4-6,15H,1-3H2,(H,16,17)(H,18,19)