[3-(tert-butylamino)-2-oxidanyl-propyl] benzenesulfonate

Systemtic Name: [3-(tert-butylamino)-2-oxidanyl-propyl] benzenesulfonate Openeye Name: [3-(tert-butylamino)-2-hydroxy-propyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-(tert-butylamino)-2-hydroxypropyl] ester IUPAC Name: [3-(tert-butylamino)-2-hydroxypropyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-(tert-butylamino)-2-hydroxy-propyl] ester Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COS(=O)(=O)C1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)NCC(COS(=O)(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C13H21NO4S/c1-13(2,3)14-9-11(15)10-18-19(16,17)12-7-5-4-6-8-12/h4-8,11,14-15H,9-10H2,1-3H3