N1,N3-bis[(2S)-2,3-bis(oxidanyl)propyl]-5-nitro-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[(2S)-2,3-bis(oxidanyl)propyl]-5-nitro-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[(2S)-2,3-dihydroxypropyl]-5-nitro-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[(2S)-2,3-dihydroxypropyl]-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[(2S)-2,3-dihydroxypropyl]-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-bis[(2S)-2,3-dihydroxypropyl]-5-nitro-isophthalamide Formula: C14H19N3O8 MolecularWeight: 357.31596

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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)NCC(CO)O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)NC[C@@H](CO)O)[N+](=O)[O-])C(=O)NC[C@@H](CO)O

InChI

InChI=1S/C14H19N3O8/c18-6-11(20)4-15-13(22)8-1-9(3-10(2-8)17(24)25)14(23)16-5-12(21)7-19/h1-3,11-12,18-21H,4-7H2,(H,15,22)(H,16,23)/t11-,12-/m0/s1