(2-chloranylquinolin-3-yl)methyl 4-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-(methylsulfonylmethyl)benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C19H16ClNO4S/c1-26(23,24)12-13-6-8-14(9-7-13)19(22)25-11-16-10-15-4-2-3-5-17(15)21-18(16)20/h2-10H,11-12H2,1H3