(3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-methylsulfonylbenzoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-methylsulfonylbenzoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC=CC=C3S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC=CC=C3S(=O)(=O)C)Cl

InChI

InChI=1S/C19H16ClNO4S/c1-12-13-7-3-5-9-15(13)21-16(18(12)20)11-25-19(22)14-8-4-6-10-17(14)26(2,23)24/h3-10H,11H2,1-2H3