N-[3-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[3-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoro-benzamide CAS Name: N-[3-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]-4-fluorobenzamide IUPAC Name: N-[3-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluorobenzamide Traditional Name: N-[3-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoro-benzamide Formula: C20H13BrFN3O4 MolecularWeight: 458.237323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)F)NC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)F)NC=C3C=C(C=C(C3=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H13BrFN3O4/c21-18-10-17(25(28)29)8-13(19(18)26)11-23-15-2-1-3-16(9-15)24-20(27)12-4-6-14(22)7-5-12/h1-11,23H,(H,24,27)