1-[3-(aminomethyl)-5-methylsulfanyl-2-oxidanyl-phenyl]propan-1-one hydrochloride

Systemtic Name: 1-[3-(aminomethyl)-5-methylsulfanyl-2-oxidanyl-phenyl]propan-1-one hydrochloride Openeye Name: 1-[3-(aminomethyl)-2-hydroxy-5-methylsulfanyl-phenyl]propan-1-one hydrochloride CAS Name: 1-[3-(aminomethyl)-2-hydroxy-5-(methylthio)phenyl]-1-propanone hydrochloride IUPAC Name: 1-[3-(aminomethyl)-2-hydroxy-5-methylsulfanylphenyl]propan-1-one hydrochloride Traditional Name: 1-[3-(aminomethyl)-2-hydroxy-5-(methylthio)phenyl]propan-1-one hydrochloride Formula: C11H16ClNO2S MolecularWeight: 261.76824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=C1O)CN)SC.Cl

Isomeric SMILES

CCC(=O)C1=CC(=CC(=C1O)CN)SC.Cl

InChI

InChI=1S/C11H15NO2S.ClH/c1-3-10(13)9-5-8(15-2)4-7(6-12)11(9)14;/h4-5,14H,3,6,12H2,1-2H3;1H