methyl 4-[(2-methylquinolin-4-yl)-methylsulfonyloxy-methyl]benzoate

Systemtic Name: methyl 4-[(2-methylquinolin-4-yl)-methylsulfonyloxy-methyl]benzoate Openeye Name: methyl 4-[(2-methyl-4-quinolyl)-methylsulfonyloxy-methyl]benzoate CAS Name: 4-[(2-methyl-4-quinolinyl)-methylsulfonyloxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-methylquinolin-4-yl)-methylsulfonyloxymethyl]benzoate Traditional Name: 4-[(2-methyl-4-quinolyl)-methylsulfonyloxy-methyl]benzoic acid methyl ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(C3=CC=C(C=C3)C(=O)OC)OS(=O)(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(C3=CC=C(C=C3)C(=O)OC)OS(=O)(=O)C

InChI

InChI=1S/C20H19NO5S/c1-13-12-17(16-6-4-5-7-18(16)21-13)19(26-27(3,23)24)14-8-10-15(11-9-14)20(22)25-2/h4-12,19H,1-3H3