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

Systemtic Name: 2-chloranyl-N-(2-cyanoethyl)-N-ethyl-4-nitro-benzamide Openeye Name: 2-chloro-N-(2-cyanoethyl)-N-ethyl-4-nitro-benzamide CAS Name: 2-chloro-N-(2-cyanoethyl)-N-ethyl-4-nitrobenzamide IUPAC Name: 2-chloro-N-(2-cyanoethyl)-N-ethyl-4-nitrobenzamide Traditional Name: 2-chloro-N-(2-cyanoethyl)-N-ethyl-4-nitro-benzamide Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClN3O3/c1-2-15(7-3-6-14)12(17)10-5-4-9(16(18)19)8-11(10)13/h4-5,8H,2-3,7H2,1H3