[4-[[(4-fluorophenyl)sulfonyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(4-fluorophenyl)sulfonyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(4-fluorophenyl)sulfonyl-isopropyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(4-fluorophenyl)sulfonyl-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [4-[[(4-fluorophenyl)sulfonyl-propan-2-ylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(4-fluorophenyl)sulfonyl-isopropyl-amino]methyl]phenyl] ester Formula: C17H20FNO5S2 MolecularWeight: 401.472803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FNO5S2/c1-13(2)19(26(22,23)17-10-6-15(18)7-11-17)12-14-4-8-16(9-5-14)24-25(3,20)21/h4-11,13H,12H2,1-3H3