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

Systemtic Name: 2-bromanyl-N-[4-[[(3-iodanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 2-bromo-N-[4-[[(3-iodo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 2-bromo-N-[4-[[(3-iodo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 2-bromo-N-[4-[[(3-iodo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: 2-bromo-N-[4-[[(3-iodo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Formula: C22H17BrIN3O4 MolecularWeight: 594.19655

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Br)C=C(C1=O)I

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Br)C=C(C1=O)I

InChI

InChI=1S/C22H17BrIN3O4/c1-31-19-11-13(10-18(24)20(19)28)12-25-27-21(29)14-6-8-15(9-7-14)26-22(30)16-4-2-3-5-17(16)23/h2-12,25H,1H3,(H,26,30)(H,27,29)