2-fluoranyl-N-[3-[[(3-iodanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[3-[[(3-iodanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 2-fluoro-N-[3-[[(3-iodo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 2-fluoro-N-[3-[[(3-iodo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 2-fluoro-N-[3-[[(3-iodo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: 2-fluoro-N-[3-[[(3-iodo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Formula: C22H17FIN3O4 MolecularWeight: 533.290953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3F)C=C(C1=O)I

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3F)C=C(C1=O)I

InChI

InChI=1S/C22H17FIN3O4/c1-31-19-10-13(9-18(24)20(19)28)12-25-27-21(29)14-5-4-6-15(11-14)26-22(30)16-7-2-3-8-17(16)23/h2-12,25H,1H3,(H,26,30)(H,27,29)