[4-[[(4-fluorophenyl)methyl-propanoyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(4-fluorophenyl)methyl-propanoyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(4-fluorophenyl)methyl-propanoyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(4-fluorophenyl)methyl-(1-oxopropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[(4-fluorophenyl)methyl-propanoylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(4-fluorobenzyl)-propionyl-amino]methyl]phenyl] ester Formula: C18H20FNO4S MolecularWeight: 365.419103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=CC=C(C=C1)OS(=O)(=O)C)CC2=CC=C(C=C2)F

Isomeric SMILES

CCC(=O)N(CC1=CC=C(C=C1)OS(=O)(=O)C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H20FNO4S/c1-3-18(21)20(12-14-4-8-16(19)9-5-14)13-15-6-10-17(11-7-15)24-25(2,22)23/h4-11H,3,12-13H2,1-2H3