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

Systemtic Name: [4-[[cyclobutylcarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Openeye Name: [4-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [4-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [4-[[cyclobutanecarbonyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H27NO5S MolecularWeight: 369.47568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO5S/c1-14(2)25(21,22)24-17-9-7-15(8-10-17)13-19(11-12-23-3)18(20)16-5-4-6-16/h7-10,14,16H,4-6,11-13H2,1-3H3