N-[2,3-bis(oxidanyl)propyl]-3-methanoyl-5-nitro-benzamide

Systemtic Name: N-[2,3-bis(oxidanyl)propyl]-3-methanoyl-5-nitro-benzamide Openeye Name: N-(2,3-dihydroxypropyl)-3-formyl-5-nitro-benzamide CAS Name: N-(2,3-dihydroxypropyl)-3-formyl-5-nitrobenzamide IUPAC Name: N-(2,3-dihydroxypropyl)-3-formyl-5-nitrobenzamide Traditional Name: 3-formyl-N-glyceryl-5-nitro-benzamide Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)NCC(CO)O)[N+](=O)[O-])C=O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)NCC(CO)O)[N+](=O)[O-])C=O

InChI

InChI=1S/C11H12N2O6/c14-5-7-1-8(3-9(2-7)13(18)19)11(17)12-4-10(16)6-15/h1-3,5,10,15-16H,4,6H2,(H,12,17)