[3-[[2-methoxyethyl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [3-[[2-methoxyethyl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [3-[[2-methoxyethyl(1-naphthylsulfonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [3-[[2-methoxyethyl(1-naphthalenylsulfonyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[2-methoxyethyl(naphthalen-1-ylsulfonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [3-[[2-methoxyethyl(1-naphthylsulfonyl)amino]methyl]phenyl] ester Formula: C26H24FNO6S2 MolecularWeight: 529.600263

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H24FNO6S2/c1-33-17-16-28(35(29,30)26-11-5-8-21-7-2-3-10-25(21)26)19-20-6-4-9-23(18-20)34-36(31,32)24-14-12-22(27)13-15-24/h2-15,18H,16-17,19H2,1H3