sodium; 3-azanyl-2-oxidanyl-benzenesulfonate; benzene-1,3-diol; iron; 4-nitroaniline; sodium

Systemtic Name: sodium; 3-azanyl-2-oxidanyl-benzenesulfonate; benzene-1,3-diol; iron; 4-nitroaniline; sodium Openeye Name: sodium; 3-amino-2-hydroxy-benzenesulfonate; benzene-1,3-diol; iron; 4-nitroaniline; sodium CAS Name: sodium; 3-amino-2-hydroxybenzenesulfonate; benzene-1,3-diol; iron; 4-nitroaniline; sodium IUPAC Name: sodium; 3-amino-2-hydroxybenzenesulfonate; benzene-1,3-diol; iron; 4-nitroaniline; sodium Traditional Name: sodium; 3-amino-2-hydroxy-besylate; iron; (4-nitrophenyl)amine; resorcinol; sodium Formula: C18H18FeN3Na2O8S MolecularWeight: 538.24036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)O.C1=CC(=C(C(=C1)S(=O)(=O)[O-])O)N.C1=CC(=CC=C1N)[N+](=O)[O-].[Na].[Na+].[Fe]

Isomeric SMILES

C1=CC(=CC(=C1)O)O.C1=CC(=C(C(=C1)S(=O)(=O)[O-])O)N.C1=CC(=CC=C1N)[N+](=O)[O-].[Na].[Na+].[Fe]

InChI

InChI=1S/C6H6N2O2.C6H7NO4S.C6H6O2.Fe.2Na/c7-5-1-3-6(4-2-5)8(9)10;7-4-2-1-3-5(6(4)8)12(9,10)11;7-5-2-1-3-6(8)4-5;;;/h1-4H,7H2;1-3,8H,7H2,(H,9,10,11);1-4,7-8H;;;/q;;;;;+1/p-1