[4-chloranyl-2-[(oxolan-2-ylmethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-chloranyl-2-[(oxolan-2-ylmethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-chloro-2-[(tetrahydrofuran-2-ylmethylamino)methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-chloro-2-[(2-oxolanylmethylamino)methyl]phenyl] ester IUPAC Name: [4-chloro-2-[(oxolan-2-ylmethylamino)methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-chloro-2-[(tetrahydrofurfurylamino)methyl]phenyl] ester Formula: C18H19ClFNO4S MolecularWeight: 399.864163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNCC2=C(C=CC(=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CC(OC1)CNCC2=C(C=CC(=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19ClFNO4S/c19-14-3-8-18(13(10-14)11-21-12-16-2-1-9-24-16)25-26(22,23)17-6-4-15(20)5-7-17/h3-8,10,16,21H,1-2,9,11-12H2