[5-[[butan-2-yl(cyclopentylcarbonyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[butan-2-yl(cyclopentylcarbonyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[cyclopentanecarbonyl(sec-butyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[butan-2-yl-[cyclopentyl(oxo)methyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[butan-2-yl(cyclopentanecarbonyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[cyclopentanecarbonyl(sec-butyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C19H29NO5S MolecularWeight: 383.50226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2CCCC2

Isomeric SMILES

CCC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2CCCC2

InChI

InChI=1S/C19H29NO5S/c1-5-14(2)20(19(21)16-8-6-7-9-16)13-15-10-11-17(24-3)18(12-15)25-26(4,22)23/h10-12,14,16H,5-9,13H2,1-4H3