[4-(dimethylamino)-2,6-dimethyl-pyridin-1-ium-1-yl] N,N-dimethylcarbamate; tetraphenylboranuide

Systemtic Name: [4-(dimethylamino)-2,6-dimethyl-pyridin-1-ium-1-yl] N,N-dimethylcarbamate; tetraphenylboranuide Openeye Name: [4-(dimethylamino)-2,6-dimethyl-pyridin-1-ium-1-yl] N,N-dimethylcarbamate; tetraphenylboranuide CAS Name: N,N-dimethylcarbamic acid [4-(dimethylamino)-2,6-dimethyl-1-pyridin-1-iumyl] ester; tetraphenylboranuide IUPAC Name: [4-(dimethylamino)-2,6-dimethylpyridin-1-ium-1-yl] N,N-dimethylcarbamate; tetraphenylboranuide Traditional Name: N,N-dimethylcarbamic acid [4-(dimethylamino)-2,6-dimethyl-pyridin-1-ium-1-yl] ester; tetraphenylboranuide Formula: C36H40BN3O2 MolecularWeight: 557.5327

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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.CC1=CC(=CC(=[N+]1OC(=O)N(C)C)C)N(C)C

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC(=CC(=[N+]1OC(=O)N(C)C)C)N(C)C

InChI

InChI=1S/C24H20B.C12H20N3O2/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;1-9-7-11(13(3)4)8-10(2)15(9)17-12(16)14(5)6/h1-20H;7-8H,1-6H3/q-1;+1