[5-[(3-acetyloxy-5-nitro-4-oxidanyl-phenyl)methyl]-3-nitro-2-oxidanyl-phenyl] ethanoate

Systemtic Name: [5-[(3-acetyloxy-5-nitro-4-oxidanyl-phenyl)methyl]-3-nitro-2-oxidanyl-phenyl] ethanoate Openeye Name: [5-[(3-acetoxy-4-hydroxy-5-nitro-phenyl)methyl]-2-hydroxy-3-nitro-phenyl] acetate CAS Name: acetic acid [5-[(3-acetyloxy-4-hydroxy-5-nitrophenyl)methyl]-2-hydroxy-3-nitrophenyl] ester IUPAC Name: [5-[(3-acetyloxy-4-hydroxy-5-nitrophenyl)methyl]-2-hydroxy-3-nitrophenyl] acetate Traditional Name: acetic acid [5-(3-acetoxy-4-hydroxy-5-nitro-benzyl)-2-hydroxy-3-nitro-phenyl] ester Formula: C17H14N2O10 MolecularWeight: 406.30046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=CC(=C1O)[N+](=O)[O-])CC2=CC(=C(C(=C2)OC(=O)C)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC(=CC(=C1O)[N+](=O)[O-])CC2=CC(=C(C(=C2)OC(=O)C)O)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O10/c1-8(20)28-14-6-10(4-12(16(14)22)18(24)25)3-11-5-13(19(26)27)17(23)15(7-11)29-9(2)21/h4-7,22-23H,3H2,1-2H3