[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 6-iodanyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 6-iodanyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 6-iodo-2-phenyl-quinoline-4-carboxylate CAS Name: 6-iodo-2-phenyl-4-quinolinecarboxylic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 6-iodo-2-phenylquinoline-4-carboxylate Traditional Name: 6-iodo-2-phenyl-cinchoninic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C24H15IN2O5 MolecularWeight: 538.29077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)I)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)I)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H15IN2O5/c25-17-8-11-21-19(12-17)20(13-22(26-21)15-4-2-1-3-5-15)24(29)32-14-23(28)16-6-9-18(10-7-16)27(30)31/h1-13H,14H2