2-azanyl-4,6-dinitro-phenol; 2-azanyl-4-nitro-phenol; 2-azanyl-5-nitro-phenol

Systemtic Name: 2-azanyl-4,6-dinitro-phenol; 2-azanyl-4-nitro-phenol; 2-azanyl-5-nitro-phenol Openeye Name: 2-amino-4,6-dinitro-phenol; 2-amino-4-nitro-phenol; 2-amino-5-nitro-phenol CAS Name: 2-amino-4,6-dinitrophenol; 2-amino-4-nitrophenol; 2-amino-5-nitrophenol IUPAC Name: 2-amino-4,6-dinitrophenol; 2-amino-4-nitrophenol; 2-amino-5-nitrophenol Traditional Name: 2-amino-4,6-dinitro-phenol; 2-amino-4-nitro-phenol; 2-amino-5-nitro-phenol Formula: C18H17N7O11 MolecularWeight: 507.36788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5N3O5.2C6H6N2O3/c7-4-1-3(8(11)12)2-5(6(4)10)9(13)14;7-5-3-4(8(10)11)1-2-6(5)9;7-5-2-1-4(8(10)11)3-6(5)9/h1-2,10H,7H2;2*1-3,9H,7H2