(2-methylquinolin-8-yl) 3-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-methylquinolin-8-yl) 3-(methylsulfonylmethyl)benzoate Openeye Name: (2-methyl-8-quinolyl) 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid (2-methyl-8-quinolyl) ester Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C)C=C1

InChI

InChI=1S/C19H17NO4S/c1-13-9-10-15-6-4-8-17(18(15)20-13)24-19(21)16-7-3-5-14(11-16)12-25(2,22)23/h3-11H,12H2,1-2H3