[5-[[cyclohexylcarbonyl(2-methylpropyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[cyclohexylcarbonyl(2-methylpropyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[cyclohexanecarbonyl(isobutyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[[cyclohexyl(oxo)methyl]-(2-methylpropyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclohexanecarbonyl(2-methylpropyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[cyclohexanecarbonyl(isobutyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C20H31NO5S MolecularWeight: 397.52884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2CCCCC2

Isomeric SMILES

CC(C)CN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2CCCCC2

InChI

InChI=1S/C20H31NO5S/c1-15(2)13-21(20(22)17-8-6-5-7-9-17)14-16-10-11-18(25-3)19(12-16)26-27(4,23)24/h10-12,15,17H,5-9,13-14H2,1-4H3