butan-2-yl(triphenyl)boranuide; (4-cyanophenyl)methylsulfanium

Systemtic Name: butan-2-yl(triphenyl)boranuide; (4-cyanophenyl)methylsulfanium Openeye Name: (4-cyanophenyl)methylsulfonium; triphenyl(sec-butyl)boranuide CAS Name: butan-2-yl(triphenyl)boranuide; (4-cyanophenyl)methylsulfonium IUPAC Name: butan-2-yl(triphenyl)boranuide; (4-cyanophenyl)methylsulfanium Traditional Name: (4-cyanobenzyl)sulfonium; triphenyl(sec-butyl)boranuide Formula: C30H32BNS MolecularWeight: 449.45778

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C(C)CC.C1=CC(=CC=C1C[SH2+])C#N

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C(C)CC.C1=CC(=CC=C1C[SH2+])C#N

InChI

InChI=1S/C22H24B.C8H7NS/c1-3-19(2)23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;9-5-7-1-3-8(6-10)4-2-7/h4-19H,3H2,1-2H3;1-4,10H,6H2/q-1;/p+1