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

Systemtic Name: hexyl 2,6-dimethyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate Openeye Name: hexyl 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonyl-3-indolecarboxylic acid hexyl ester IUPAC Name: hexyl 5-(methanesulfonamido)-2,6-dimethyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 1-mesyl-5-(methanesulfonamido)-2,6-dimethyl-indole-3-carboxylic acid hexyl ester Formula: C19H28N2O6S2 MolecularWeight: 444.56542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O6S2/c1-6-7-8-9-10-27-19(22)18-14(3)21(29(5,25)26)17-11-13(2)16(12-15(17)18)20-28(4,23)24/h11-12,20H,6-10H2,1-5H3