(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-methylsulfonylbenzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C19H16ClNO5S MolecularWeight: 405.85204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C19H16ClNO5S/c1-25-15-7-6-12-8-14(18(20)21-17(12)10-15)11-26-19(22)13-4-3-5-16(9-13)27(2,23)24/h3-10H,11H2,1-2H3