3-fluoranyl-2-methoxy-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 3-fluoranyl-2-methoxy-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 3-fluoro-2-methoxy-5-morpholinosulfonyl-benzoic acid CAS Name: 3-fluoro-2-methoxy-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 3-fluoro-2-methoxy-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 3-fluoro-2-methoxy-5-morpholinosulfonyl-benzoic acid Formula: C12H14FNO6S MolecularWeight: 319.306063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)O)S(=O)(=O)N2CCOCC2)F

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)O)S(=O)(=O)N2CCOCC2)F

InChI

InChI=1S/C12H14FNO6S/c1-19-11-9(12(15)16)6-8(7-10(11)13)21(17,18)14-2-4-20-5-3-14/h6-7H,2-5H2,1H3,(H,15,16)