(2,2,4-trimethyl-1-methylsulfonyl-quinolin-6-yl) methanesulfonate

Systemtic Name: (2,2,4-trimethyl-1-methylsulfonyl-quinolin-6-yl) methanesulfonate Openeye Name: (2,2,4-trimethyl-1-methylsulfonyl-6-quinolyl) methanesulfonate CAS Name: methanesulfonic acid (2,2,4-trimethyl-1-methylsulfonyl-6-quinolinyl) ester IUPAC Name: (2,2,4-trimethyl-1-methylsulfonylquinolin-6-yl) methanesulfonate Traditional Name: methanesulfonic acid (1-mesyl-2,2,4-trimethyl-6-quinolyl) ester Formula: C14H19NO5S2 MolecularWeight: 345.43436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OS(=O)(=O)C)S(=O)(=O)C)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OS(=O)(=O)C)S(=O)(=O)C)(C)C

InChI

InChI=1S/C14H19NO5S2/c1-10-9-14(2,3)15(21(4,16)17)13-7-6-11(8-12(10)13)20-22(5,18)19/h6-9H,1-5H3