6-methoxy-2-methyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylic acid

Systemtic Name: 6-methoxy-2-methyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylic acid Openeye Name: 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-indole-3-carboxylic acid CAS Name: 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-3-indolecarboxylic acid IUPAC Name: 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonylindole-3-carboxylic acid Traditional Name: 1-mesyl-5-(methanesulfonamido)-6-methoxy-2-methyl-indole-3-carboxylic acid Formula: C13H16N2O7S2 MolecularWeight: 376.40534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1S(=O)(=O)C)OC)NS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1S(=O)(=O)C)OC)NS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C13H16N2O7S2/c1-7-12(13(16)17)8-5-9(14-23(3,18)19)11(22-2)6-10(8)15(7)24(4,20)21/h5-6,14H,1-4H3,(H,16,17)