2,5-dibutoxy-4-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-benzenediazonium

Systemtic Name: 2,5-dibutoxy-4-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-benzenediazonium Openeye Name: 2,5-dibutoxy-4-[4-(1,1,3,3-tetramethylbutyl)phenyl]sulfanyl-benzenediazonium CAS Name: 2,5-dibutoxy-4-[[4-(2,4,4-trimethylpentan-2-yl)phenyl]thio]benzenediazonium IUPAC Name: 2,5-dibutoxy-4-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanylbenzenediazonium Traditional Name: 2,5-dibutoxy-4-[[4-(1,1,3,3-tetramethylbutyl)phenyl]thio]benzenediazonium Formula: C28H41N2O2S+ MolecularWeight: 469.70234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)SC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)SC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C28H41N2O2S/c1-8-10-16-31-24-19-26(25(18-23(24)30-29)32-17-11-9-2)33-22-14-12-21(13-15-22)28(6,7)20-27(3,4)5/h12-15,18-19H,8-11,16-17,20H2,1-7H3/q+1