3-[(3-methoxyphenyl)amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[(3-methoxyphenyl)amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 2-hydroxy-3-(3-methoxyanilino)propane-1-sulfonic acid CAS Name: 2-hydroxy-3-(3-methoxyanilino)-1-propanesulfonic acid IUPAC Name: 2-hydroxy-3-(3-methoxyanilino)propane-1-sulfonic acid Traditional Name: 2-hydroxy-3-(m-anisidino)propane-1-sulfonic acid Formula: C10H15NO5S MolecularWeight: 261.2948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NCC(CS(=O)(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1)NCC(CS(=O)(=O)O)O

InChI

InChI=1S/C10H15NO5S/c1-16-10-4-2-3-8(5-10)11-6-9(12)7-17(13,14)15/h2-5,9,11-12H,6-7H2,1H3,(H,13,14,15)