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

Systemtic Name: N-[4-[[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]-2-nitro-benzamide Openeye Name: N-[4-[[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]-2-nitro-benzamide CAS Name: N-[4-[[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenyl]-2-nitrobenzamide IUPAC Name: N-[4-[[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]-2-nitrobenzamide Traditional Name: N-[4-[[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]-2-nitro-benzamide Formula: C22H17BrN4O6 MolecularWeight: 513.29758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C=C(C1=O)Br

InChI

InChI=1S/C22H17BrN4O6/c1-33-19-11-13(10-17(23)20(19)28)12-24-26-21(29)14-6-8-15(9-7-14)25-22(30)16-4-2-3-5-18(16)27(31)32/h2-12,24H,1H3,(H,25,30)(H,26,29)