2-chloranyl-4-nitro-N-(1-oxidanylbutan-2-yl)benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-(1-oxidanylbutan-2-yl)benzamide Openeye Name: 2-chloro-N-[1-(hydroxymethyl)propyl]-4-nitro-benzamide CAS Name: 2-chloro-N-(1-hydroxybutan-2-yl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-(1-hydroxybutan-2-yl)-4-nitrobenzamide Traditional Name: 2-chloro-N-(1-methylolpropyl)-4-nitro-benzamide Formula: C11H13ClN2O4 MolecularWeight: 272.68492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13ClN2O4/c1-2-7(6-15)13-11(16)9-4-3-8(14(17)18)5-10(9)12/h3-5,7,15H,2,6H2,1H3,(H,13,16)