2-[methylsulfonyl-(2-prop-2-enylcyclohex-2-en-1-yl)amino]benzenediazonium tetrafluoroborate

Systemtic Name: 2-[methylsulfonyl-(2-prop-2-enylcyclohex-2-en-1-yl)amino]benzenediazonium tetrafluoroborate Openeye Name: 2-[(2-allylcyclohex-2-en-1-yl)-methylsulfonyl-amino]benzenediazonium tetrafluoroborate CAS Name: 2-[methylsulfonyl-(2-prop-2-enyl-1-cyclohex-2-enyl)amino]benzenediazonium tetrafluoroborate IUPAC Name: 2-[methylsulfonyl-(2-prop-2-enylcyclohex-2-en-1-yl)amino]benzenediazonium tetrafluoroborate Traditional Name: 2-[(2-allylcyclohex-2-en-1-yl)-mesyl-amino]benzenediazonium tetrafluoroborate Formula: C16H20BF4N3O2S MolecularWeight: 405.218513

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CS(=O)(=O)N(C1CCCC=C1CC=C)C2=CC=CC=C2[N+]#N

Isomeric SMILES

[B-](F)(F)(F)F.CS(=O)(=O)N(C1CCCC=C1CC=C)C2=CC=CC=C2[N+]#N

InChI

InChI=1S/C16H20N3O2S.BF4/c1-3-8-13-9-4-6-11-15(13)19(22(2,20)21)16-12-7-5-10-14(16)18-17;2-1(3,4)5/h3,5,7,9-10,12,15H,1,4,6,8,11H2,2H3;/q+1;-1