[[3-(2,4-dinitrophenoxy)-2-oxidanyl-propyl]amino] hydrogen sulfate

Systemtic Name: [[3-(2,4-dinitrophenoxy)-2-oxidanyl-propyl]amino] hydrogen sulfate Openeye Name: [[3-(2,4-dinitrophenoxy)-2-hydroxy-propyl]amino] hydrogen sulfate CAS Name: sulfuric acid [[3-(2,4-dinitrophenoxy)-2-hydroxypropyl]amino] ester IUPAC Name: [[3-(2,4-dinitrophenoxy)-2-hydroxypropyl]amino] hydrogen sulfate Traditional Name: sulfuric acid [[3-(2,4-dinitrophenoxy)-2-hydroxy-propyl]amino] ester Formula: C9H11N3O10S MolecularWeight: 353.26274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N3O10S/c13-7(4-10-22-23(18,19)20)5-21-9-2-1-6(11(14)15)3-8(9)12(16)17/h1-3,7,10,13H,4-5H2,(H,18,19,20)