[[3-(4-nitrophenoxy)-2-oxidanyl-butyl]amino] sulfate

Systemtic Name: [[3-(4-nitrophenoxy)-2-oxidanyl-butyl]amino] sulfate Openeye Name: [[2-hydroxy-3-(4-nitrophenoxy)butyl]amino] sulfate CAS Name: [[2-hydroxy-3-(4-nitrophenoxy)butyl]amino] sulfate IUPAC Name: [[2-hydroxy-3-(4-nitrophenoxy)butyl]amino] sulfate Traditional Name: [[2-hydroxy-3-(4-nitrophenoxy)butyl]amino] sulfate Formula: C10H13N2O8S- MolecularWeight: 321.28382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CNOS(=O)(=O)[O-])O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C(CNOS(=O)(=O)[O-])O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O8S/c1-7(10(13)6-11-20-21(16,17)18)19-9-4-2-8(3-5-9)12(14)15/h2-5,7,10-11,13H,6H2,1H3,(H,16,17,18)/p-1