(4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitro-phenyl)disulfanyl]-2-nitro-benzoic acid; hydrate

Systemtic Name: (4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitro-phenyl)disulfanyl]-2-nitro-benzoic acid; hydrate Openeye Name: (4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitro-phenyl)disulfanyl]-2-nitro-benzoic acid; hydrate CAS Name: (4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid; hydrate IUPAC Name: (4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid; hydrate Traditional Name: (4-carboxylatophenyl)mercury; 5-[(3-carboxy-4-nitro-phenyl)disulfanyl]-2-nitro-benzoic acid; hydrate Formula: C21H14HgN2O11S2- MolecularWeight: 735.06266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])[Hg].C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O)[N+](=O)[O-].O

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])[Hg].C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O)[N+](=O)[O-].O

InChI

InChI=1S/C14H8N2O8S2.C7H5O2.Hg.H2O/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20;8-7(9)6-4-2-1-3-5-6;;/h1-6H,(H,17,18)(H,19,20);2-5H,(H,8,9);;1H2/p-1