2-methoxy-3,5-dinitro-N-oxidanyl-4-sulfo-cyclohexa-2,5-dien-1-imine oxide

Systemtic Name: 2-methoxy-3,5-dinitro-N-oxidanyl-4-sulfo-cyclohexa-2,5-dien-1-imine oxide Openeye Name: N-hydroxy-2-methoxy-3,5-dinitro-4-sulfo-cyclohexa-2,5-dien-1-imine oxide CAS Name: N-hydroxy-2-methoxy-3,5-dinitro-4-sulfo-1-cyclohexa-2,5-dienimine oxide IUPAC Name: N-hydroxy-2-methoxy-3,5-dinitro-4-sulfocyclohexa-2,5-dien-1-imine oxide Traditional Name: N-hydroxy-2-methoxy-3,5-dinitro-4-sulfo-cyclohexa-2,5-dien-1-imine oxide Formula: C7H7N3O10S MolecularWeight: 325.20958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(C(=CC1=[N+](O)[O-])[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC\1=C(C(C(=C/C1=[N+](/O)\[O-])[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H7N3O10S/c1-20-6-3(8(11)12)2-4(9(13)14)7(21(17,18)19)5(6)10(15)16/h2,7H,1H3,(H,11,12)(H,17,18,19)