(E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-amine hydrochloride

Systemtic Name: (E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-amine hydrochloride Openeye Name: (E,3S)-5-methyl-1-methylsulfonyl-hex-1-en-3-amine hydrochloride CAS Name: (E,3S)-5-methyl-1-methylsulfonyl-1-hexen-3-amine hydrochloride IUPAC Name: (E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-amine hydrochloride Traditional Name: [(E,1S)-1-isobutyl-3-mesyl-allyl]amine hydrochloride Formula: C8H18ClNO2S MolecularWeight: 227.75202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CS(=O)(=O)C)N.Cl

Isomeric SMILES

CC(C)C[C@@H](/C=C/S(=O)(=O)C)N.Cl

InChI

InChI=1S/C8H17NO2S.ClH/c1-7(2)6-8(9)4-5-12(3,10)11;/h4-5,7-8H,6,9H2,1-3H3;1H/b5-4+;/t8-;/m1./s1