[2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenyl-1H-indol-3-yl)ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate Openeye Name: [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 1-oxidopyridin-1-ium-2-carboxylate CAS Name: 1-oxido-2-pyridin-1-iumcarboxylic acid [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 1-oxidopyridin-1-ium-2-carboxylate Traditional Name: 1-oxidopyridin-1-ium-2-carboxylic acid [2-keto-2-(2-phenyl-1H-indol-3-yl)ethyl] ester Formula: C22H16N2O4 MolecularWeight: 372.37344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=O)COC(=O)C4=CC=CC=[N+]4[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=O)COC(=O)C4=CC=CC=[N+]4[O-]

InChI

InChI=1S/C22H16N2O4/c25-19(14-28-22(26)18-12-6-7-13-24(18)27)20-16-10-4-5-11-17(16)23-21(20)15-8-2-1-3-9-15/h1-13,23H,14H2