1-[(3,5-dimethoxyphenyl)amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 1-[(3,5-dimethoxyphenyl)amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 1-(3,5-dimethoxyanilino)-2-hydroxy-propane-1-sulfonic acid CAS Name: 1-(3,5-dimethoxyanilino)-2-hydroxy-1-propanesulfonic acid IUPAC Name: 1-(3,5-dimethoxyanilino)-2-hydroxypropane-1-sulfonic acid Traditional Name: 1-(3,5-dimethoxyanilino)-2-hydroxy-propane-1-sulfonic acid Formula: C11H17NO6S MolecularWeight: 291.32078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NO6S/c1-7(13)11(19(14,15)16)12-8-4-9(17-2)6-10(5-8)18-3/h4-7,11-13H,1-3H3,(H,14,15,16)