[2-[(furan-2-ylmethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [2-[(furan-2-ylmethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [2-[(2-furylmethylamino)methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [2-[(2-furanylmethylamino)methyl]phenyl] ester IUPAC Name: [2-[(furan-2-ylmethylamino)methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [2-[(2-furfurylamino)methyl]phenyl] ester Formula: C18H16FNO4S MolecularWeight: 361.387343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCC2=CC=CO2)OS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)CNCC2=CC=CO2)OS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FNO4S/c19-15-7-9-17(10-8-15)25(21,22)24-18-6-2-1-4-14(18)12-20-13-16-5-3-11-23-16/h1-11,20H,12-13H2