[4-[(2-dimethylaminoethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-[(2-dimethylaminoethylamino)methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[(2-dimethylaminoethylamino)methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[(2-dimethylaminoethylamino)methyl]phenyl] ester IUPAC Name: [4-[(2-dimethylaminoethylamino)methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-[(2-dimethylaminoethylamino)methyl]phenyl] ester Formula: C17H21FN2O3S MolecularWeight: 352.423643

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNCC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(C)CCNCC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN2O3S/c1-20(2)12-11-19-13-14-3-7-16(8-4-14)23-24(21,22)17-9-5-15(18)6-10-17/h3-10,19H,11-13H2,1-2H3