methyl 5-[butanoyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate

Systemtic Name: methyl 5-[butanoyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate Openeye Name: methyl 5-[butanoyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 2-methyl-1-methylsulfonyl-5-[methylsulfonyl(1-oxobutyl)amino]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 5-[butanoyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 5-[butyryl(mesyl)amino]-1-mesyl-2-methyl-indole-3-carboxylic acid methyl ester Formula: C17H22N2O7S2 MolecularWeight: 430.49578

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)N(C(=C2C(=O)OC)C)S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)N(C(=C2C(=O)OC)C)S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C17H22N2O7S2/c1-6-7-15(20)19(28(5,24)25)12-8-9-14-13(10-12)16(17(21)26-3)11(2)18(14)27(4,22)23/h8-10H,6-7H2,1-5H3