[3-[[furan-2-ylcarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[furan-2-ylcarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[furan-2-carbonyl(isobutyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[2-furanyl(oxo)methyl]-(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[furan-2-carbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[2-furoyl(isobutyl)amino]methyl]phenyl] ester Formula: C17H21NO5S MolecularWeight: 351.41734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=CC=CO2

Isomeric SMILES

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=CC=CO2

InChI

InChI=1S/C17H21NO5S/c1-13(2)11-18(17(19)16-8-5-9-22-16)12-14-6-4-7-15(10-14)23-24(3,20)21/h4-10,13H,11-12H2,1-3H3