N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitro-phenoxy)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitro-phenoxy)acetamide CAS Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitrophenoxy)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitrophenoxy)acetamide Traditional Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-methoxy-2-nitro-phenoxy)acetamide Formula: C20H21N3O5 MolecularWeight: 383.39784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N3O5/c1-14-9-15(2)11-16(10-14)22(8-4-7-21)20(24)13-28-19-6-5-17(27-3)12-18(19)23(25)26/h5-6,9-12H,4,8,13H2,1-3H3