[3-[[cyclobutylcarbonyl(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[cyclobutylcarbonyl(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[cyclobutanecarbonyl(2-furylmethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[cyclobutyl(oxo)methyl]-(2-furanylmethyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[cyclobutanecarbonyl(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[cyclobutanecarbonyl(2-furfuryl)amino]methyl]phenyl] ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)C3CCC3

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)C3CCC3

InChI

InChI=1S/C18H21NO5S/c1-25(21,22)24-16-8-2-5-14(11-16)12-19(13-17-9-4-10-23-17)18(20)15-6-3-7-15/h2,4-5,8-11,15H,3,6-7,12-13H2,1H3