phenyl 6-methoxy-2-methyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate

Systemtic Name: phenyl 6-methoxy-2-methyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate Openeye Name: phenyl 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-3-indolecarboxylic acid phenyl ester IUPAC Name: phenyl 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 1-mesyl-5-(methanesulfonamido)-6-methoxy-2-methyl-indole-3-carboxylic acid phenyl ester Formula: C19H20N2O7S2 MolecularWeight: 452.5013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1S(=O)(=O)C)OC)NS(=O)(=O)C)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1S(=O)(=O)C)OC)NS(=O)(=O)C)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O7S2/c1-12-18(19(22)28-13-8-6-5-7-9-13)14-10-15(20-29(3,23)24)17(27-2)11-16(14)21(12)30(4,25)26/h5-11,20H,1-4H3