butyl-[(Z)-3-methyl-1-(4-methylphenyl)sulfonyl-but-1-en-2-yl]azanium

Systemtic Name: butyl-[(Z)-3-methyl-1-(4-methylphenyl)sulfonyl-but-1-en-2-yl]azanium Openeye Name: butyl-[(1Z)-2-methyl-1-(p-tolylsulfonylmethylene)propyl]ammonium CAS Name: butyl-[(Z)-3-methyl-1-(4-methylphenyl)sulfonylbut-1-en-2-yl]ammonium IUPAC Name: butyl-[(Z)-3-methyl-1-(4-methylphenyl)sulfonylbut-1-en-2-yl]azanium Traditional Name: butyl-[(Z)-1-isopropyl-2-tosyl-vinyl]ammonium Formula: C16H26NO2S+ MolecularWeight: 296.44814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C(=CS(=O)(=O)C1=CC=C(C=C1)C)C(C)C

Isomeric SMILES

CCCC[NH2+]/C(=C\S(=O)(=O)C1=CC=C(C=C1)C)/C(C)C

InChI

InChI=1S/C16H25NO2S/c1-5-6-11-17-16(13(2)3)12-20(18,19)15-9-7-14(4)8-10-15/h7-10,12-13,17H,5-6,11H2,1-4H3/p+1/b16-12-