1-[(3,5-dimethoxyphenyl)amino]propane-1-sulfonic acid

Systemtic Name: 1-[(3,5-dimethoxyphenyl)amino]propane-1-sulfonic acid Openeye Name: 1-(3,5-dimethoxyanilino)propane-1-sulfonic acid CAS Name: 1-(3,5-dimethoxyanilino)-1-propanesulfonic acid IUPAC Name: 1-(3,5-dimethoxyanilino)propane-1-sulfonic acid Traditional Name: 1-(3,5-dimethoxyanilino)propane-1-sulfonic acid Formula: C11H17NO5S MolecularWeight: 275.32138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1=CC(=CC(=C1)OC)OC)S(=O)(=O)O

Isomeric SMILES

CCC(NC1=CC(=CC(=C1)OC)OC)S(=O)(=O)O

InChI

InChI=1S/C11H17NO5S/c1-4-11(18(13,14)15)12-8-5-9(16-2)7-10(6-8)17-3/h5-7,11-12H,4H2,1-3H3,(H,13,14,15)