(E)-1-ethoxy-3-[2-[(4-methylphenyl)sulfonylcarbamoyl]phenyl]-1-oxidanyl-prop-1-ene-2-diazonium

Systemtic Name: (E)-1-ethoxy-3-[2-[(4-methylphenyl)sulfonylcarbamoyl]phenyl]-1-oxidanyl-prop-1-ene-2-diazonium Openeye Name: (E)-1-ethoxy-1-hydroxy-3-[2-(p-tolylsulfonylcarbamoyl)phenyl]prop-1-ene-2-diazonium CAS Name: (E)-1-ethoxy-1-hydroxy-3-[2-[[(4-methylphenyl)sulfonylamino]-oxomethyl]phenyl]-1-propene-2-diazonium IUPAC Name: (E)-1-ethoxy-1-hydroxy-3-[2-[(4-methylphenyl)sulfonylcarbamoyl]phenyl]prop-1-ene-2-diazonium Traditional Name: (E)-1-ethoxy-1-hydroxy-3-[2-(tosylcarbamoyl)phenyl]prop-1-ene-2-diazonium Formula: C19H20N3O5S+ MolecularWeight: 402.4442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(CC1=CC=CC=C1C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)[N+]#N)O

Isomeric SMILES

CCO/C(=C(\CC1=CC=CC=C1C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)/[N+]#N)/O

InChI

InChI=1S/C19H19N3O5S/c1-3-27-19(24)17(21-20)12-14-6-4-5-7-16(14)18(23)22-28(25,26)15-10-8-13(2)9-11-15/h4-11H,3,12H2,1-2H3,(H-,22,23,24)/p+1/b19-17+