ethyl 2,6-diphenyl-1-(phenylmethyl)pyridin-1-ium-4-carboxylate perchlorate

Systemtic Name: ethyl 2,6-diphenyl-1-(phenylmethyl)pyridin-1-ium-4-carboxylate perchlorate Openeye Name: ethyl 1-benzyl-2,6-diphenyl-pyridin-1-ium-4-carboxylate perchlorate CAS Name: 2,6-diphenyl-1-(phenylmethyl)-4-pyridin-1-iumcarboxylic acid ethyl ester perchlorate IUPAC Name: ethyl 1-benzyl-2,6-diphenylpyridin-1-ium-4-carboxylate perchlorate Traditional Name: 1-benzyl-2,6-diphenyl-pyridin-1-ium-4-carboxylic acid ethyl ester perchlorate Formula: C27H24ClNO6 MolecularWeight: 493.93556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=[N+](C(=C1)C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)C1=CC(=[N+](C(=C1)C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C27H24NO2.ClHO4/c1-2-30-27(29)24-18-25(22-14-8-4-9-15-22)28(20-21-12-6-3-7-13-21)26(19-24)23-16-10-5-11-17-23;2-1(3,4)5/h3-19H,2,20H2,1H3;(H,2,3,4,5)/q+1;/p-1