[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl] ethanesulfonate

Systemtic Name: [5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[(4-fluorobenzyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C17H20FNO4S MolecularWeight: 353.408403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20FNO4S/c1-3-24(20,21)23-17-10-14(6-9-16(17)22-2)12-19-11-13-4-7-15(18)8-5-13/h4-10,19H,3,11-12H2,1-2H3