2,5-diethoxy-4-(4-methylphenyl)sulfanyl-benzenediazonium; fluoranyl-bis(oxidanidyl)borane

Systemtic Name: 2,5-diethoxy-4-(4-methylphenyl)sulfanyl-benzenediazonium; fluoranyl-bis(oxidanidyl)borane Openeye Name: 2,5-diethoxy-4-(p-tolylsulfanyl)benzenediazonium; fluoro(dioxido)borane CAS Name: 2,5-diethoxy-4-[(4-methylphenyl)thio]benzenediazonium; fluoro(dioxido)borane IUPAC Name: 2,5-diethoxy-4-(4-methylphenyl)sulfanylbenzenediazonium; fluoro(dioxido)borane Traditional Name: 2,5-diethoxy-4-(p-tolylthio)benzenediazonium; fluoro(dioxido)borane Formula: C34H38BFN4O6S2 MolecularWeight: 692.628123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])F.CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C

Isomeric SMILES

B([O-])([O-])F.CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C

InChI

InChI=1S/2C17H19N2O2S.BFO2/c2*1-4-20-15-11-17(16(21-5-2)10-14(15)19-18)22-13-8-6-12(3)7-9-13;2-1(3)4/h2*6-11H,4-5H2,1-3H3;/q2*+1;-2