[2-[3-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron ethanoate

Systemtic Name: [2-[3-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron ethanoate Openeye Name: [2-[3-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron acetate CAS Name: [2-[3-(3,8-diamino-6-phenyl-5-phenanthridin-5-iumyl)propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron acetate IUPAC Name: [2-[3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron acetate Traditional Name: [2-[3-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)propyl]-3-$l^{1}-boranyl-1$l^{2}-boriran-2-yl]boron acetate Formula: C26H25B3N3O2 MolecularWeight: 443.9286

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Descriptors Computed from Structure

Canonical SMILES:

[B]C1[B]C1([B])CCC[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=C2C5=CC=CC=C5)N)N.CC(=O)[O-]

Isomeric SMILES

[B]C1[B]C1([B])CCC[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=C2C5=CC=CC=C5)N)N.CC(=O)[O-]

InChI

InChI=1S/C24H21B3N3.C2H4O2/c25-23-24(26,27-23)11-4-12-30-21-14-17(29)8-10-19(21)18-9-7-16(28)13-20(18)22(30)15-5-2-1-3-6-15;1-2(3)4/h1-3,5-10,13-14,23,29H,4,11-12,28H2;1H3,(H,3,4)