[5-[[cyclobutylcarbonyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[cyclobutylcarbonyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[cyclobutanecarbonyl(tetrahydrofuran-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[[cyclobutyl(oxo)methyl]-(2-oxolanylmethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclobutanecarbonyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[cyclobutanecarbonyl(tetrahydrofurfuryl)amino]methyl]-2-methoxy-phenyl] ester Formula: C19H27NO6S MolecularWeight: 397.48578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2CCCO2)C(=O)C3CCC3)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2CCCO2)C(=O)C3CCC3)OS(=O)(=O)C

InChI

InChI=1S/C19H27NO6S/c1-24-17-9-8-14(11-18(17)26-27(2,22)23)12-20(13-16-7-4-10-25-16)19(21)15-5-3-6-15/h8-9,11,15-16H,3-7,10,12-13H2,1-2H3