(3-morpholin-4-ylsulfonylphenyl)methyl 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate CAS Name: 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate Traditional Name: 7-fluoro-2-keto-3,4-dihydro-1H-quinoline-4-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H21FN2O6S MolecularWeight: 448.464643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3CC(=O)NC4=C3C=CC(=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3CC(=O)NC4=C3C=CC(=C4)F

InChI

InChI=1S/C21H21FN2O6S/c22-15-4-5-17-18(12-20(25)23-19(17)11-15)21(26)30-13-14-2-1-3-16(10-14)31(27,28)24-6-8-29-9-7-24/h1-5,10-11,18H,6-9,12-13H2,(H,23,25)