3-[ethyl-(3-hydroxyphenyl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[ethyl-(3-hydroxyphenyl)amino]propane-1-sulfonic acid Openeye Name: 3-(N-ethyl-3-hydroxy-anilino)propane-1-sulfonic acid CAS Name: 3-(N-ethyl-3-hydroxyanilino)-1-propanesulfonic acid IUPAC Name: 3-(N-ethyl-3-hydroxyanilino)propane-1-sulfonic acid Traditional Name: 3-(N-ethyl-3-hydroxy-anilino)propane-1-sulfonic acid Formula: C11H17NO4S MolecularWeight: 259.32198

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCS(=O)(=O)O)C1=CC(=CC=C1)O

Isomeric SMILES

CCN(CCCS(=O)(=O)O)C1=CC(=CC=C1)O

InChI

InChI=1S/C11H17NO4S/c1-2-12(7-4-8-17(14,15)16)10-5-3-6-11(13)9-10/h3,5-6,9,13H,2,4,7-8H2,1H3,(H,14,15,16)