2-(aminomethyl)-6-methylsulfonyl-4-propan-2-yl-phenol hydrochloride

Systemtic Name: 2-(aminomethyl)-6-methylsulfonyl-4-propan-2-yl-phenol hydrochloride Openeye Name: 2-(aminomethyl)-4-isopropyl-6-methylsulfonyl-phenol hydrochloride CAS Name: 2-(aminomethyl)-6-methylsulfonyl-4-propan-2-ylphenol hydrochloride IUPAC Name: 2-(aminomethyl)-6-methylsulfonyl-4-propan-2-ylphenol hydrochloride Traditional Name: 2-(aminomethyl)-4-isopropyl-6-mesyl-phenol hydrochloride Formula: C11H18ClNO3S MolecularWeight: 279.78352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NO3S.ClH/c1-7(2)8-4-9(6-12)11(13)10(5-8)16(3,14)15;/h4-5,7,13H,6,12H2,1-3H3;1H