[4-chloranyl-2-[[(4-fluorophenyl)methylamino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-chloranyl-2-[[(4-fluorophenyl)methylamino]methyl]phenyl] ethanesulfonate Openeye Name: [4-chloro-2-[[(4-fluorophenyl)methylamino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-chloro-2-[[(4-fluorophenyl)methylamino]methyl]phenyl] ester IUPAC Name: [4-chloro-2-[[(4-fluorophenyl)methylamino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-chloro-2-[[(4-fluorobenzyl)amino]methyl]phenyl] ester Formula: C16H17ClFNO3S MolecularWeight: 357.827483

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CNCC2=CC=C(C=C2)F

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CNCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H17ClFNO3S/c1-2-23(20,21)22-16-8-5-14(17)9-13(16)11-19-10-12-3-6-15(18)7-4-12/h3-9,19H,2,10-11H2,1H3