2-(aminomethyl)-4-tert-butyl-6-methylsulfinyl-phenol hydrochloride

Systemtic Name: 2-(aminomethyl)-4-tert-butyl-6-methylsulfinyl-phenol hydrochloride Openeye Name: 2-(aminomethyl)-4-tert-butyl-6-methylsulfinyl-phenol hydrochloride CAS Name: 2-(aminomethyl)-4-tert-butyl-6-methylsulfinylphenol hydrochloride IUPAC Name: 2-(aminomethyl)-4-tert-butyl-6-methylsulfinylphenol hydrochloride Traditional Name: 2-(aminomethyl)-4-tert-butyl-6-methylsulfinyl-phenol hydrochloride Formula: C12H20ClNO2S MolecularWeight: 277.8107

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)S(=O)C)O)CN.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)S(=O)C)O)CN.Cl

InChI

InChI=1S/C12H19NO2S.ClH/c1-12(2,3)9-5-8(7-13)11(14)10(6-9)16(4)15;/h5-6,14H,7,13H2,1-4H3;1H