2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid

Systemtic Name: 2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid Openeye Name: 2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid CAS Name: 2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid IUPAC Name: 2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid Traditional Name: 2-methyl-5-(2-methylsulfonyloxyethyl)-1H-indole-3-carboxylic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)CCOS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)CCOS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C13H15NO5S/c1-8-12(13(15)16)10-7-9(3-4-11(10)14-8)5-6-19-20(2,17)18/h3-4,7,14H,5-6H2,1-2H3,(H,15,16)