[2,4,6-trinitro-3,5-bis(oxidanyl)phenyl] dihydrogen phosphate

Systemtic Name: [2,4,6-trinitro-3,5-bis(oxidanyl)phenyl] dihydrogen phosphate Openeye Name: (3,5-dihydroxy-2,4,6-trinitro-phenyl) dihydrogen phosphate CAS Name: (3,5-dihydroxy-2,4,6-trinitrophenyl) dihydrogen phosphate IUPAC Name: (3,5-dihydroxy-2,4,6-trinitrophenyl) dihydrogen phosphate Traditional Name: (3,5-dihydroxy-2,4,6-trinitro-phenyl) dihydrogen phosphate Formula: C6H4N3O12P MolecularWeight: 341.082621

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Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1O)[N+](=O)[O-])OP(=O)(O)O)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1(=C(C(=C(C(=C1O)[N+](=O)[O-])OP(=O)(O)O)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C6H4N3O12P/c10-4-1(7(12)13)5(11)3(9(16)17)6(2(4)8(14)15)21-22(18,19)20/h10-11H,(H2,18,19,20)