4-[2-(4-methylsulfinylbutylamino)-1-oxidanyl-ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-(4-methylsulfinylbutylamino)-1-oxidanyl-ethyl]benzene-1,2-diol Openeye Name: 4-[1-hydroxy-2-(4-methylsulfinylbutylamino)ethyl]benzene-1,2-diol CAS Name: 4-[1-hydroxy-2-(4-methylsulfinylbutylamino)ethyl]benzene-1,2-diol IUPAC Name: 4-[1-hydroxy-2-(4-methylsulfinylbutylamino)ethyl]benzene-1,2-diol Traditional Name: 4-[1-hydroxy-2-(4-methylsulfinylbutylamino)ethyl]pyrocatechol Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCCCNCC(C1=CC(=C(C=C1)O)O)O

Isomeric SMILES

CS(=O)CCCCNCC(C1=CC(=C(C=C1)O)O)O

InChI

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