methyl 1-methyl-3-methylsulfonyl-indole-2-carboxylate

Systemtic Name: methyl 1-methyl-3-methylsulfonyl-indole-2-carboxylate Openeye Name: methyl 1-methyl-3-methylsulfonyl-indole-2-carboxylate CAS Name: 1-methyl-3-methylsulfonyl-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-3-methylsulfonylindole-2-carboxylate Traditional Name: 3-mesyl-1-methyl-indole-2-carboxylic acid methyl ester Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C12H13NO4S/c1-13-9-7-5-4-6-8(9)11(18(3,15)16)10(13)12(14)17-2/h4-7H,1-3H3