3-(tert-butylamino)-4-methyl-2-(1-oxidanylpropyl)benzenesulfonic acid

Systemtic Name: 3-(tert-butylamino)-4-methyl-2-(1-oxidanylpropyl)benzenesulfonic acid Openeye Name: 3-(tert-butylamino)-2-(1-hydroxypropyl)-4-methyl-benzenesulfonic acid CAS Name: 3-(tert-butylamino)-2-(1-hydroxypropyl)-4-methylbenzenesulfonic acid IUPAC Name: 3-(tert-butylamino)-2-(1-hydroxypropyl)-4-methylbenzenesulfonic acid Traditional Name: 3-(tert-butylamino)-2-(1-hydroxypropyl)-4-methyl-besylic acid Formula: C14H23NO4S MolecularWeight: 301.40172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1NC(C)(C)C)C)S(=O)(=O)O)O

Isomeric SMILES

CCC(C1=C(C=CC(=C1NC(C)(C)C)C)S(=O)(=O)O)O

InChI

InChI=1S/C14H23NO4S/c1-6-10(16)12-11(20(17,18)19)8-7-9(2)13(12)15-14(3,4)5/h7-8,10,15-16H,6H2,1-5H3,(H,17,18,19)