6-methyl-2,2-diphenyl-1-(thiophen-2-ylmethyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene

Systemtic Name: 6-methyl-2,2-diphenyl-1-(thiophen-2-ylmethyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene Openeye Name: 6-methyl-2,2-diphenyl-1-(2-thienylmethyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene CAS Name: 6-methyl-2,2-diphenyl-1-(thiophen-2-ylmethyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene IUPAC Name: 6-methyl-2,2-diphenyl-1-(thiophen-2-ylmethyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene Traditional Name: 6-methyl-2,2-diphenyl-1-(2-thenyl)-4-(trifluoromethyl)-3-aza-1-azonia-2-boranuidacyclohexa-4,6-diene Formula: C22H20BF3N2S MolecularWeight: 412.27881

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1(NC(=CC(=[N+]1CC2=CC=CS2)C)C(F)(F)F)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-]1(NC(=CC(=[N+]1CC2=CC=CS2)C)C(F)(F)F)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20BF3N2S/c1-17-15-21(22(24,25)26)27-23(18-9-4-2-5-10-18,19-11-6-3-7-12-19)28(17)16-20-13-8-14-29-20/h2-15,27H,16H2,1H3