5-azido-2-nitro-N-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]benzamide

Systemtic Name: 5-azido-2-nitro-N-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]benzamide Openeye Name: 5-azido-N-(1-formyl-2,3,4,5-tetrahydroxy-pentyl)-2-nitro-benzamide CAS Name: 5-azido-2-nitro-N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)benzamide IUPAC Name: 5-azido-2-nitro-N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)benzamide Traditional Name: 5-azido-N-(1-formyl-2,3,4,5-tetrahydroxy-pentyl)-2-nitro-benzamide Formula: C13H15N5O8 MolecularWeight: 369.2869

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])C(=O)NC(C=O)C(C(C(CO)O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])C(=O)NC(C=O)C(C(C(CO)O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O8/c14-17-16-6-1-2-9(18(25)26)7(3-6)13(24)15-8(4-19)11(22)12(23)10(21)5-20/h1-4,8,10-12,20-23H,5H2,(H,15,24)