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

Systemtic Name: ethyl 1-(4-nitrophenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate Openeye Name: ethyl 1-(4-nitrophenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate CAS Name: 1-(4-nitrophenyl)-4,6-diphenyl-2-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitrophenyl)-4,6-diphenylpyridin-1-ium-2-carboxylate Traditional Name: 1-(4-nitrophenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylic acid ethyl ester Formula: C26H21N2O4+ MolecularWeight: 425.45594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=[N+]1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=[N+]1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21N2O4/c1-2-32-26(29)25-18-21(19-9-5-3-6-10-19)17-24(20-11-7-4-8-12-20)27(25)22-13-15-23(16-14-22)28(30)31/h3-18H,2H2,1H3/q+1