propan-2-yl 3-methylpyridin-1-ium-1-carboxylate; tetraphenylboranuide

Systemtic Name: propan-2-yl 3-methylpyridin-1-ium-1-carboxylate; tetraphenylboranuide Openeye Name: isopropyl 3-methylpyridin-1-ium-1-carboxylate; tetraphenylboranuide CAS Name: 3-methyl-1-pyridin-1-iumcarboxylic acid propan-2-yl ester; tetraphenylboranuide IUPAC Name: propan-2-yl 3-methylpyridin-1-ium-1-carboxylate; tetraphenylboranuide Traditional Name: 3-methylpyridin-1-ium-1-carboxylic acid isopropyl ester; tetraphenylboranuide Formula: C34H34BNO2 MolecularWeight: 499.45026

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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=C[N+](=CC=C1)C(=O)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H20B.C10H14NO2/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;1-8(2)13-10(12)11-6-4-5-9(3)7-11/h1-20H;4-8H,1-3H3/q-1;+1