1-[2-(4-chlorophenyl)ethyl]-4,6-diphenyl-pyridin-1-ium-2-carboxylate

Systemtic Name: 1-[2-(4-chlorophenyl)ethyl]-4,6-diphenyl-pyridin-1-ium-2-carboxylate Openeye Name: 1-[2-(4-chlorophenyl)ethyl]-4,6-diphenyl-pyridin-1-ium-2-carboxylate CAS Name: 1-[2-(4-chlorophenyl)ethyl]-4,6-diphenyl-2-pyridin-1-iumcarboxylate IUPAC Name: 1-[2-(4-chlorophenyl)ethyl]-4,6-diphenylpyridin-1-ium-2-carboxylate Traditional Name: 1-[2-(4-chlorophenyl)ethyl]-4,6-diphenyl-pyridin-1-ium-2-carboxylate Formula: C26H20ClNO2 MolecularWeight: 413.8955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C(=O)[O-])CCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C(=O)[O-])CCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H20ClNO2/c27-23-13-11-19(12-14-23)15-16-28-24(21-9-5-2-6-10-21)17-22(18-25(28)26(29)30)20-7-3-1-4-8-20/h1-14,17-18H,15-16H2