4-chloranyl-N-(2-cyanoethyl)-N-methyl-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-cyanoethyl)-N-methyl-2-nitro-benzamide Openeye Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-2-nitro-benzamide CAS Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-2-nitrobenzamide IUPAC Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-2-nitrobenzamide Traditional Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-2-nitro-benzamide Formula: C11H10ClN3O3 MolecularWeight: 267.6684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)C(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H10ClN3O3/c1-14(6-2-5-13)11(16)9-4-3-8(12)7-10(9)15(17)18/h3-4,7H,2,6H2,1H3