methyl 2-[(4-fluorophenyl)methylsulfonyl]quinoline-3-carboxylate

Systemtic Name: methyl 2-[(4-fluorophenyl)methylsulfonyl]quinoline-3-carboxylate Openeye Name: methyl 2-[(4-fluorophenyl)methylsulfonyl]quinoline-3-carboxylate CAS Name: 2-[(4-fluorophenyl)methylsulfonyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-fluorophenyl)methylsulfonyl]quinoline-3-carboxylate Traditional Name: 2-(4-fluorobenzyl)sulfonylquinoline-3-carboxylic acid methyl ester Formula: C18H14FNO4S MolecularWeight: 359.371463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2N=C1S(=O)(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2N=C1S(=O)(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FNO4S/c1-24-18(21)15-10-13-4-2-3-5-16(13)20-17(15)25(22,23)11-12-6-8-14(19)9-7-12/h2-10H,11H2,1H3