(Z)-3-[(4-methylphenyl)sulfonylamino]-5-methylsulfanyl-2-oxidanyl-pent-1-ene-1-diazonium

Systemtic Name: (Z)-3-[(4-methylphenyl)sulfonylamino]-5-methylsulfanyl-2-oxidanyl-pent-1-ene-1-diazonium Openeye Name: (Z)-2-hydroxy-5-methylsulfanyl-3-(p-tolylsulfonylamino)pent-1-ene-1-diazonium CAS Name: (Z)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-5-(methylthio)-1-pentene-1-diazonium IUPAC Name: (Z)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-5-methylsulfanylpent-1-ene-1-diazonium Traditional Name: (Z)-2-hydroxy-5-(methylthio)-3-(tosylamino)pent-1-ene-1-diazonium Formula: C13H18N3O3S2+ MolecularWeight: 328.43032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=C[N+]#N)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)/C(=C/[N+]#N)/O

InChI

InChI=1S/C13H17N3O3S2/c1-10-3-5-11(6-4-10)21(18,19)16-12(7-8-20-2)13(17)9-15-14/h3-6,9,12,16H,7-8H2,1-2H3/p+1/b13-9-