4-[(1S,2R)-1-oxidanyl-2-(propan-2-ylamino)butyl]benzene-1,2-diol hydrochloride

Systemtic Name: 4-[(1S,2R)-1-oxidanyl-2-(propan-2-ylamino)butyl]benzene-1,2-diol hydrochloride Openeye Name: 4-[(1S,2R)-1-hydroxy-2-(isopropylamino)butyl]benzene-1,2-diol hydrochloride CAS Name: 4-[(1S,2R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol hydrochloride IUPAC Name: 4-[(1S,2R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol hydrochloride Traditional Name: 4-[(1S,2R)-1-hydroxy-2-(isopropylamino)butyl]pyrocatechol hydrochloride Formula: C13H22ClNO3 MolecularWeight: 275.77168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.Cl

Isomeric SMILES

CC[C@H]([C@H](C1=CC(=C(C=C1)O)O)O)NC(C)C.Cl

InChI

InChI=1S/C13H21NO3.ClH/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9;/h5-8,10,13-17H,4H2,1-3H3;1H/t10-,13+;/m1./s1