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

Systemtic Name: [[4-(2,4-dinitrophenoxy)-2-oxidanyl-butyl]amino] hydrogen sulfate Openeye Name: [[4-(2,4-dinitrophenoxy)-2-hydroxy-butyl]amino] hydrogen sulfate CAS Name: sulfuric acid [[4-(2,4-dinitrophenoxy)-2-hydroxybutyl]amino] ester IUPAC Name: [[4-(2,4-dinitrophenoxy)-2-hydroxybutyl]amino] hydrogen sulfate Traditional Name: sulfuric acid [[4-(2,4-dinitrophenoxy)-2-hydroxy-butyl]amino] ester Formula: C10H13N3O10S MolecularWeight: 367.28932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O10S/c14-8(6-11-23-24(19,20)21)3-4-22-10-2-1-7(12(15)16)5-9(10)13(17)18/h1-2,5,8,11,14H,3-4,6H2,(H,19,20,21)