N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitro-2-oxidanyl-benzamide

Systemtic Name: N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitro-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitro-benzamide CAS Name: 2-hydroxy-N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitrobenzamide IUPAC Name: 2-hydroxy-N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitrobenzamide Traditional Name: 2-hydroxy-N-[2-(2-hydroxyethylamino)ethyl]-3,5-dinitro-benzamide Formula: C11H14N4O7 MolecularWeight: 314.25146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)NCCNCCO)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)NCCNCCO)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O7/c16-4-3-12-1-2-13-11(18)8-5-7(14(19)20)6-9(10(8)17)15(21)22/h5-6,12,16-17H,1-4H2,(H,13,18)