butyl 2,6-dimethyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate

Systemtic Name: butyl 2,6-dimethyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate Openeye Name: butyl 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonyl-3-indolecarboxylic acid butyl ester IUPAC Name: butyl 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 1-mesyl-5-(methanesulfonamido)-2,6-dimethyl-indole-3-carboxylic acid butyl ester Formula: C17H24N2O6S2 MolecularWeight: 416.51226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(C2=CC(=C(C=C21)NS(=O)(=O)C)C)S(=O)(=O)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(N(C2=CC(=C(C=C21)NS(=O)(=O)C)C)S(=O)(=O)C)C

InChI

InChI=1S/C17H24N2O6S2/c1-6-7-8-25-17(20)16-12(3)19(27(5,23)24)15-9-11(2)14(10-13(15)16)18-26(4,21)22/h9-10,18H,6-8H2,1-5H3