quinolin-8-ylmethyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: quinolin-8-ylmethyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 8-quinolylmethyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid 8-quinolylmethyl ester Formula: C21H19FN2O5S MolecularWeight: 430.449363

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)F

InChI

InChI=1S/C21H19FN2O5S/c22-18-7-6-16(13-19(18)30(26,27)24-9-11-28-12-10-24)21(25)29-14-17-4-1-3-15-5-2-8-23-20(15)17/h1-8,13H,9-12,14H2