(4-dimethylaminophenyl)-[4-(dimethylamino)pyridin-1-ium-1-yl]methanone; tetraphenylboranuide

Systemtic Name: (4-dimethylaminophenyl)-[4-(dimethylamino)pyridin-1-ium-1-yl]methanone; tetraphenylboranuide Openeye Name: (4-dimethylaminophenyl)-[4-(dimethylamino)pyridin-1-ium-1-yl]methanone; tetraphenylboranuide CAS Name: (4-dimethylaminophenyl)-[4-(dimethylamino)-1-pyridin-1-iumyl]methanone; tetraphenylboranuide IUPAC Name: (4-dimethylaminophenyl)-[4-(dimethylamino)pyridin-1-ium-1-yl]methanone; tetraphenylboranuide Traditional Name: (4-dimethylaminophenyl)-[4-(dimethylamino)pyridin-1-ium-1-yl]methanone; tetraphenylboranuide Formula: C40H40BN3O MolecularWeight: 589.5761

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CN(C)C1=CC=C(C=C1)C(=O)[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CN(C)C1=CC=C(C=C1)C(=O)[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C24H20B.C16H20N3O/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-17(2)14-7-5-13(6-8-14)16(20)19-11-9-15(10-12-19)18(3)4/h1-20H;5-12H,1-4H3/q-1;+1