[5-[[ethanoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate

Systemtic Name: [5-[[ethanoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate Openeye Name: [5-[[acetyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [5-[[acetyl(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [5-[[acetyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C16H25NO6S MolecularWeight: 359.4378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO6S/c1-12(2)24(19,20)23-16-10-14(6-7-15(16)22-5)11-17(13(3)18)8-9-21-4/h6-7,10,12H,8-9,11H2,1-5H3