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

Systemtic Name: 4-[2-(butylamino)-1-oxidanyl-ethyl]benzene-1,2-diol hydrochloride Openeye Name: 4-[2-(butylamino)-1-hydroxy-ethyl]benzene-1,2-diol hydrochloride CAS Name: 4-[2-(butylamino)-1-hydroxyethyl]benzene-1,2-diol hydrochloride IUPAC Name: 4-[2-(butylamino)-1-hydroxyethyl]benzene-1,2-diol hydrochloride Traditional Name: 4-[2-(butylamino)-1-hydroxy-ethyl]pyrocatechol hydrochloride Formula: C12H20ClNO3 MolecularWeight: 261.7451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(C1=CC(=C(C=C1)O)O)O.Cl

Isomeric SMILES

CCCCNCC(C1=CC(=C(C=C1)O)O)O.Cl

InChI

InChI=1S/C12H19NO3.ClH/c1-2-3-6-13-8-12(16)9-4-5-10(14)11(15)7-9;/h4-5,7,12-16H,2-3,6,8H2,1H3;1H