[2-methoxy-5-[(2-methoxyethylamino)methyl]phenyl] propane-2-sulfonate

Systemtic Name: [2-methoxy-5-[(2-methoxyethylamino)methyl]phenyl] propane-2-sulfonate Openeye Name: [2-methoxy-5-[(2-methoxyethylamino)methyl]phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [2-methoxy-5-[(2-methoxyethylamino)methyl]phenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [2-methoxy-5-[(2-methoxyethylamino)methyl]phenyl] ester Formula: C14H23NO5S MolecularWeight: 317.40112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1=C(C=CC(=C1)CNCCOC)OC

Isomeric SMILES

CC(C)S(=O)(=O)OC1=C(C=CC(=C1)CNCCOC)OC

InChI

InChI=1S/C14H23NO5S/c1-11(2)21(16,17)20-14-9-12(5-6-13(14)19-4)10-15-7-8-18-3/h5-6,9,11,15H,7-8,10H2,1-4H3