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

Systemtic Name: 2,6-diphenyl-1-(phenylmethyl)pyridin-1-ium-4-carboxylate Openeye Name: 1-benzyl-2,6-diphenyl-pyridin-1-ium-4-carboxylate CAS Name: 2,6-diphenyl-1-(phenylmethyl)-4-pyridin-1-iumcarboxylate IUPAC Name: 1-benzyl-2,6-diphenylpyridin-1-ium-4-carboxylate Traditional Name: 1-benzyl-2,6-diphenyl-pyridin-1-ium-4-carboxylate Formula: C25H19NO2 MolecularWeight: 365.42386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C=C(C=C2C3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C=C(C=C2C3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C25H19NO2/c27-25(28)22-16-23(20-12-6-2-7-13-20)26(18-19-10-4-1-5-11-19)24(17-22)21-14-8-3-9-15-21/h1-17H,18H2