methyl 3-azanyl-5-(3-azanyl-5-methoxycarbonyl-4-nitrooxy-phenyl)carbonyl-2-nitrooxy-benzoate

Systemtic Name: methyl 3-azanyl-5-(3-azanyl-5-methoxycarbonyl-4-nitrooxy-phenyl)carbonyl-2-nitrooxy-benzoate Openeye Name: methyl 3-amino-5-(3-amino-5-methoxycarbonyl-4-nitrooxy-benzoyl)-2-nitrooxy-benzoate CAS Name: 3-amino-5-[(3-amino-5-methoxycarbonyl-4-nitrooxyphenyl)-oxomethyl]-2-nitrooxybenzoic acid methyl ester IUPAC Name: methyl 3-amino-5-(3-amino-5-methoxycarbonyl-4-nitrooxybenzoyl)-2-nitrooxybenzoate Traditional Name: 3-amino-5-(3-amino-5-carbomethoxy-4-nitrooxy-benzoyl)-2-nitrooxy-benzoic acid methyl ester Formula: C17H14N4O11 MolecularWeight: 450.31326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O11/c1-29-16(23)9-3-7(5-11(18)14(9)31-20(25)26)13(22)8-4-10(17(24)30-2)15(12(19)6-8)32-21(27)28/h3-6H,18-19H2,1-2H3