N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-nitrophenoxy)ethanamide Openeye Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-nitrophenoxy)acetamide CAS Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-2-pyrrolyl)-2-(4-nitrophenoxy)acetamide IUPAC Name: N-(3-cyano-1-cyclopentyl-4,5-dimethylpyrrol-2-yl)-2-(4-nitrophenoxy)acetamide Traditional Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-nitrophenoxy)acetamide Formula: C20H22N4O4 MolecularWeight: 382.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C3CCCC3)C

InChI

InChI=1S/C20H22N4O4/c1-13-14(2)23(15-5-3-4-6-15)20(18(13)11-21)22-19(25)12-28-17-9-7-16(8-10-17)24(26)27/h7-10,15H,3-6,12H2,1-2H3,(H,22,25)