[1-(5-azanylnaphthalen-2-yl)-2-oxidanyl-ethyl] sulfo sulfate

Systemtic Name: [1-(5-azanylnaphthalen-2-yl)-2-oxidanyl-ethyl] sulfo sulfate Openeye Name: [1-(5-amino-2-naphthyl)-2-hydroxy-ethyl] sulfo sulfate CAS Name: sulfuric acid [1-(5-amino-2-naphthalenyl)-2-hydroxyethyl] sulfo ester IUPAC Name: [1-(5-aminonaphthalen-2-yl)-2-hydroxyethyl] sulfo sulfate Traditional Name: sulfuric acid [1-(5-amino-2-naphthyl)-2-hydroxy-ethyl] sulfo ester Formula: C12H13NO8S2 MolecularWeight: 363.36352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C(CO)OS(=O)(=O)OS(=O)(=O)O)C(=C1)N

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C(CO)OS(=O)(=O)OS(=O)(=O)O)C(=C1)N

InChI

InChI=1S/C12H13NO8S2/c13-11-3-1-2-8-6-9(4-5-10(8)11)12(7-14)20-23(18,19)21-22(15,16)17/h1-6,12,14H,7,13H2,(H,15,16,17)