N-(1-chloranyl-3-methyl-2-oxidanylidene-pentan-3-yl)-3-methyl-4-nitro-benzamide

Systemtic Name: N-(1-chloranyl-3-methyl-2-oxidanylidene-pentan-3-yl)-3-methyl-4-nitro-benzamide Openeye Name: N-(3-chloro-1-ethyl-1-methyl-2-oxo-propyl)-3-methyl-4-nitro-benzamide CAS Name: N-(1-chloro-3-methyl-2-oxopentan-3-yl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(1-chloro-3-methyl-2-oxopentan-3-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(3-chloro-1-ethyl-2-keto-1-methyl-propyl)-3-methyl-4-nitro-benzamide Formula: C14H17ClN2O4 MolecularWeight: 312.74878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN2O4/c1-4-14(3,12(18)8-15)16-13(19)10-5-6-11(17(20)21)9(2)7-10/h5-7H,4,8H2,1-3H3,(H,16,19)