3,5-dinitro-N-(1-oxidanylbutan-2-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(1-oxidanylbutan-2-yl)benzamide Openeye Name: N-[1-(hydroxymethyl)propyl]-3,5-dinitro-benzamide CAS Name: N-(1-hydroxybutan-2-yl)-3,5-dinitrobenzamide IUPAC Name: N-(1-hydroxybutan-2-yl)-3,5-dinitrobenzamide Traditional Name: N-(1-methylolpropyl)-3,5-dinitro-benzamide Formula: C11H13N3O6 MolecularWeight: 283.23742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O6/c1-2-8(6-15)12-11(16)7-3-9(13(17)18)5-10(4-7)14(19)20/h3-5,8,15H,2,6H2,1H3,(H,12,16)