5-chloranyl-N-heptan-2-yl-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-heptan-2-yl-2-nitro-benzamide Openeye Name: 5-chloro-N-(1-methylhexyl)-2-nitro-benzamide CAS Name: 5-chloro-N-heptan-2-yl-2-nitrobenzamide IUPAC Name: 5-chloro-N-heptan-2-yl-2-nitrobenzamide Traditional Name: 5-chloro-N-(1-methylhexyl)-2-nitro-benzamide Formula: C14H19ClN2O3 MolecularWeight: 298.76526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(C)NC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H19ClN2O3/c1-3-4-5-6-10(2)16-14(18)12-9-11(15)7-8-13(12)17(19)20/h7-10H,3-6H2,1-2H3,(H,16,18)