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

Systemtic Name: octyl 6-methoxy-2-methyl-1-methylsulfonyl-5-(methylsulfonylamino)indole-3-carboxylate Openeye Name: octyl 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonyl-3-indolecarboxylic acid octyl ester IUPAC Name: octyl 5-(methanesulfonamido)-6-methoxy-2-methyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 1-mesyl-5-(methanesulfonamido)-6-methoxy-2-methyl-indole-3-carboxylic acid octyl ester Formula: C21H32N2O7S2 MolecularWeight: 488.61798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O7S2/c1-6-7-8-9-10-11-12-30-21(24)20-15(2)23(32(5,27)28)18-14-19(29-3)17(13-16(18)20)22-31(4,25)26/h13-14,22H,6-12H2,1-5H3