methyl 1-(diphenylmethyl)pyridin-1-ium-3-carboxylate bromide

Systemtic Name: methyl 1-(diphenylmethyl)pyridin-1-ium-3-carboxylate bromide Openeye Name: methyl 1-benzhydrylpyridin-1-ium-3-carboxylate bromide CAS Name: 1-(diphenylmethyl)-3-pyridin-1-iumcarboxylic acid methyl ester bromide IUPAC Name: methyl 1-benzhydrylpyridin-1-ium-3-carboxylate bromide Traditional Name: 1-benzhydrylpyridin-1-ium-3-carboxylic acid methyl ester bromide Formula: C20H18BrNO2 MolecularWeight: 384.26642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C[N+](=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

COC(=O)C1=C[N+](=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H18NO2.BrH/c1-23-20(22)18-13-8-14-21(15-18)19(16-9-4-2-5-10-16)17-11-6-3-7-12-17;/h2-15,19H,1H3;1H/q+1;/p-1