[5-azanyl-2-(4-azanyl-2-sulfooxy-phenyl)phenyl] hydrogen sulfate

Systemtic Name: [5-azanyl-2-(4-azanyl-2-sulfooxy-phenyl)phenyl] hydrogen sulfate Openeye Name: [5-amino-2-(4-amino-2-sulfooxy-phenyl)phenyl] hydrogen sulfate CAS Name: sulfuric acid [5-amino-2-(4-amino-2-sulfooxyphenyl)phenyl] ester IUPAC Name: [5-amino-2-(4-amino-2-sulfooxyphenyl)phenyl] hydrogen sulfate Traditional Name: sulfuric acid [5-amino-2-(4-amino-2-sulfoxy-phenyl)phenyl] ester Formula: C12H12N2O8S2 MolecularWeight: 376.36228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)OS(=O)(=O)O)C2=C(C=C(C=C2)N)OS(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)OS(=O)(=O)O)C2=C(C=C(C=C2)N)OS(=O)(=O)O

InChI

InChI=1S/C12H12N2O8S2/c13-7-1-3-9(11(5-7)21-23(15,16)17)10-4-2-8(14)6-12(10)22-24(18,19)20/h1-6H,13-14H2,(H,15,16,17)(H,18,19,20)