(3-methylpyridin-1-ium-1-yl) N,N-diethylcarbamate; tetraphenylboranuide

Systemtic Name: (3-methylpyridin-1-ium-1-yl) N,N-diethylcarbamate; tetraphenylboranuide Openeye Name: (3-methylpyridin-1-ium-1-yl) N,N-diethylcarbamate; tetraphenylboranuide CAS Name: N,N-diethylcarbamic acid (3-methyl-1-pyridin-1-iumyl) ester; tetraphenylboranuide IUPAC Name: (3-methylpyridin-1-ium-1-yl) N,N-diethylcarbamate; tetraphenylboranuide Traditional Name: N,N-diethylcarbamic acid (3-methylpyridin-1-ium-1-yl) ester; tetraphenylboranuide Formula: C35H37BN2O2 MolecularWeight: 528.49148

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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.CCN(CC)C(=O)O[N+]1=CC=CC(=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C24H20B.C11H17N2O2/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;1-4-12(5-2)11(14)15-13-8-6-7-10(3)9-13/h1-20H;6-9H,4-5H2,1-3H3/q-1;+1