[4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenyl-borane

Systemtic Name: [4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenyl-borane Openeye Name: [4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenyl-borane CAS Name: [4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenylborane IUPAC Name: [4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenylborane Traditional Name: [4-(8-methyl-2H-1,3-benzoxazin-3-ium-3-yl)phenyl]-diphenyl-borane Formula: C27H23BNO+ MolecularWeight: 388.28862

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)[N+]4=CC5=C(C(=CC=C5)C)OC4

Isomeric SMILES

B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)[N+]4=CC5=C(C(=CC=C5)C)OC4

InChI

InChI=1S/C27H23BNO/c1-21-9-8-10-22-19-29(20-30-27(21)22)26-17-15-25(16-18-26)28(23-11-4-2-5-12-23)24-13-6-3-7-14-24/h2-19H,20H2,1H3/q+1