[2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid [2-oxo-2-(2,4,6-triiodoanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid [2-keto-2-(2,4,6-triiodoanilino)ethyl] ester Formula: C18H11I3N2O4 MolecularWeight: 700.00435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)OCC(=O)NC3=C(C=C(C=C3I)I)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)OCC(=O)NC3=C(C=C(C=C3I)I)I

InChI

InChI=1S/C18H11I3N2O4/c19-9-5-12(20)17(13(21)6-9)23-16(25)8-27-18(26)11-7-15(24)22-14-4-2-1-3-10(11)14/h1-7H,8H2,(H,22,24)(H,23,25)