6-iodanyl-2-oxidanylidene-3-phenyl-1H-quinoline-4-carboxylic acid

Systemtic Name: 6-iodanyl-2-oxidanylidene-3-phenyl-1H-quinoline-4-carboxylic acid Openeye Name: 6-iodo-2-oxo-3-phenyl-1H-quinoline-4-carboxylic acid CAS Name: 6-iodo-2-oxo-3-phenyl-1H-quinoline-4-carboxylic acid IUPAC Name: 6-iodo-2-oxo-3-phenyl-1H-quinoline-4-carboxylic acid Traditional Name: 6-iodo-2-keto-3-phenyl-1H-quinoline-4-carboxylic acid Formula: C16H10INO3 MolecularWeight: 391.15997

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=C(C=CC(=C3)I)NC2=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=C(C=CC(=C3)I)NC2=O)C(=O)O

InChI

InChI=1S/C16H10INO3/c17-10-6-7-12-11(8-10)14(16(20)21)13(15(19)18-12)9-4-2-1-3-5-9/h1-8H,(H,18,19)(H,20,21)