butyl 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylate

Systemtic Name: butyl 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylate Openeye Name: butyl 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylate CAS Name: 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylic acid butyl ester IUPAC Name: butyl 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylate Traditional Name: 6-methyl-2,2-diphenyl-4-(trichloromethyl)-1-oxa-3-azonia-2-boranuidacyclohexa-3,5-diene-5-carboxylic acid butyl ester Formula: C22H23BCl3NO3 MolecularWeight: 466.59292

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1([NH+]=C(C(=C(O1)C)C(=O)OCCCC)C(Cl)(Cl)Cl)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[B-]1([NH+]=C(C(=C(O1)C)C(=O)OCCCC)C(Cl)(Cl)Cl)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23BCl3NO3/c1-3-4-15-29-21(28)19-16(2)30-23(17-11-7-5-8-12-17,18-13-9-6-10-14-18)27-20(19)22(24,25)26/h5-14,27H,3-4,15H2,1-2H3