3-(2-nitro-4-oxidanyl-phenyl)-2-(3-nitro-4-oxidanyl-phenyl)propanenitrile

Systemtic Name: 3-(2-nitro-4-oxidanyl-phenyl)-2-(3-nitro-4-oxidanyl-phenyl)propanenitrile Openeye Name: 3-(4-hydroxy-2-nitro-phenyl)-2-(4-hydroxy-3-nitro-phenyl)propanenitrile CAS Name: 3-(4-hydroxy-2-nitrophenyl)-2-(4-hydroxy-3-nitrophenyl)propanenitrile IUPAC Name: 3-(4-hydroxy-2-nitrophenyl)-2-(4-hydroxy-3-nitrophenyl)propanenitrile Traditional Name: 3-(4-hydroxy-2-nitro-phenyl)-2-(4-hydroxy-3-nitro-phenyl)propionitrile Formula: C15H11N3O6 MolecularWeight: 329.26434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CC2=C(C=C(C=C2)O)[N+](=O)[O-])C#N)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1C(CC2=C(C=C(C=C2)O)[N+](=O)[O-])C#N)[N+](=O)[O-])O

InChI

InChI=1S/C15H11N3O6/c16-8-11(9-2-4-15(20)14(6-9)18(23)24)5-10-1-3-12(19)7-13(10)17(21)22/h1-4,6-7,11,19-20H,5H2