3-[(2-methoxy-3-methyl-phenyl)amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[(2-methoxy-3-methyl-phenyl)amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 2-hydroxy-3-(2-methoxy-3-methyl-anilino)propane-1-sulfonic acid CAS Name: 2-hydroxy-3-(2-methoxy-3-methylanilino)-1-propanesulfonic acid IUPAC Name: 2-hydroxy-3-(2-methoxy-3-methylanilino)propane-1-sulfonic acid Traditional Name: 2-hydroxy-3-(2-methoxy-3-methyl-anilino)propane-1-sulfonic acid Formula: C11H17NO5S MolecularWeight: 275.32138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NCC(CS(=O)(=O)O)O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)NCC(CS(=O)(=O)O)O)OC

InChI

InChI=1S/C11H17NO5S/c1-8-4-3-5-10(11(8)17-2)12-6-9(13)7-18(14,15)16/h3-5,9,12-13H,6-7H2,1-2H3,(H,14,15,16)