[3-[[cyclobutylcarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate

Systemtic Name: [3-[[cyclobutylcarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Openeye Name: [3-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [3-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [3-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H27NO5S MolecularWeight: 369.47568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1=CC=CC(=C1)CN(CCOC)C(=O)C2CCC2

Isomeric SMILES

CC(C)S(=O)(=O)OC1=CC=CC(=C1)CN(CCOC)C(=O)C2CCC2

InChI

InChI=1S/C18H27NO5S/c1-14(2)25(21,22)24-17-9-4-6-15(12-17)13-19(10-11-23-3)18(20)16-7-5-8-16/h4,6,9,12,14,16H,5,7-8,10-11,13H2,1-3H3