2-azanyl-4-chloranyl-5-nitro-phenol; N-(5-chloranyl-4-nitro-2-oxidanyl-phenyl)-3,4-bis(fluoranyl)benzamide

Systemtic Name: 2-azanyl-4-chloranyl-5-nitro-phenol; N-(5-chloranyl-4-nitro-2-oxidanyl-phenyl)-3,4-bis(fluoranyl)benzamide Openeye Name: 2-amino-4-chloro-5-nitro-phenol; N-(5-chloro-2-hydroxy-4-nitro-phenyl)-3,4-difluoro-benzamide CAS Name: 2-amino-4-chloro-5-nitrophenol; N-(5-chloro-2-hydroxy-4-nitrophenyl)-3,4-difluorobenzamide IUPAC Name: 2-amino-4-chloro-5-nitrophenol; N-(5-chloro-2-hydroxy-4-nitrophenyl)-3,4-difluorobenzamide Traditional Name: 2-amino-4-chloro-5-nitro-phenol; N-(5-chloro-2-hydroxy-4-nitro-phenyl)-3,4-difluoro-benzamide Formula: C19H12Cl2F2N4O7 MolecularWeight: 517.223986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2O)[N+](=O)[O-])Cl)F)F.C1=C(C(=CC(=C1Cl)[N+](=O)[O-])O)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2O)[N+](=O)[O-])Cl)F)F.C1=C(C(=CC(=C1Cl)[N+](=O)[O-])O)N

InChI

InChI=1S/C13H7ClF2N2O4.C6H5ClN2O3/c14-7-4-10(12(19)5-11(7)18(21)22)17-13(20)6-1-2-8(15)9(16)3-6;7-3-1-4(8)6(10)2-5(3)9(11)12/h1-5,19H,(H,17,20);1-2,10H,8H2