(1E)-5-methyl-1-(phenylsulfonyl)hexa-1,5-dien-3-amine hydrochloride

Systemtic Name: (1E)-5-methyl-1-(phenylsulfonyl)hexa-1,5-dien-3-amine hydrochloride Openeye Name: (1E)-1-(benzenesulfonyl)-5-methyl-hexa-1,5-dien-3-amine hydrochloride CAS Name: (1E)-1-(benzenesulfonyl)-5-methyl-3-hexa-1,5-dienamine hydrochloride IUPAC Name: (1E)-1-(benzenesulfonyl)-5-methylhexa-1,5-dien-3-amine hydrochloride Traditional Name: [1-[(E)-2-besylvinyl]-3-methyl-but-3-enyl]amine hydrochloride Formula: C13H18ClNO2S MolecularWeight: 287.80552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(C=CS(=O)(=O)C1=CC=CC=C1)N.Cl

Isomeric SMILES

CC(=C)CC(/C=C/S(=O)(=O)C1=CC=CC=C1)N.Cl

InChI

InChI=1S/C13H17NO2S.ClH/c1-11(2)10-12(14)8-9-17(15,16)13-6-4-3-5-7-13;/h3-9,12H,1,10,14H2,2H3;1H/b9-8+;