[5-[[cyclopropylcarbonyl(furan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[cyclopropylcarbonyl(furan-2-ylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[cyclopropanecarbonyl(2-furylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[[cyclopropyl(oxo)methyl]-(2-furanylmethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclopropanecarbonyl(furan-2-ylmethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[cyclopropanecarbonyl(2-furfuryl)amino]methyl]-2-methoxy-phenyl] ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C3CC3)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C3CC3)OS(=O)(=O)C

InChI

InChI=1S/C18H21NO6S/c1-23-16-8-5-13(10-17(16)25-26(2,21)22)11-19(18(20)14-6-7-14)12-15-4-3-9-24-15/h3-5,8-10,14H,6-7,11-12H2,1-2H3