4-nitro-2-[[3-[(5-nitro-2-oxidanyl-phenyl)methylamino]propylamino]methyl]phenol

Systemtic Name: 4-nitro-2-[[3-[(5-nitro-2-oxidanyl-phenyl)methylamino]propylamino]methyl]phenol Openeye Name: 2-[[3-[(2-hydroxy-5-nitro-phenyl)methylamino]propylamino]methyl]-4-nitro-phenol CAS Name: 2-[[3-[(2-hydroxy-5-nitrophenyl)methylamino]propylamino]methyl]-4-nitrophenol IUPAC Name: 2-[[3-[(2-hydroxy-5-nitrophenyl)methylamino]propylamino]methyl]-4-nitrophenol Traditional Name: 2-[[3-[(2-hydroxy-5-nitro-benzyl)amino]propylamino]methyl]-4-nitro-phenol Formula: C17H20N4O6 MolecularWeight: 376.3639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])CNCCCNCC2=C(C=CC(=C2)[N+](=O)[O-])O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])CNCCCNCC2=C(C=CC(=C2)[N+](=O)[O-])O)O

InChI

InChI=1S/C17H20N4O6/c22-16-4-2-14(20(24)25)8-12(16)10-18-6-1-7-19-11-13-9-15(21(26)27)3-5-17(13)23/h2-5,8-9,18-19,22-23H,1,6-7,10-11H2