4-bromanyl-6-[[(5-nitro-2-oxidanyl-phenyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[(5-nitro-2-oxidanyl-phenyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[(2-hydroxy-5-nitro-phenyl)methylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[(2-hydroxy-5-nitrophenyl)methylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[(2-hydroxy-5-nitrophenyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[(2-hydroxy-5-nitro-benzyl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])CNC=C2C=C(C=CC2=O)Br)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])CNC=C2C=C(C=CC2=O)Br)O

InChI

InChI=1S/C14H11BrN2O4/c15-11-1-3-13(18)9(5-11)7-16-8-10-6-12(17(20)21)2-4-14(10)19/h1-7,16,19H,8H2