(E)-N-(4-chlorophenyl)-2-cyano-3-(5-nitro-2-pyrrolidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(5-nitro-2-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(5-nitro-2-pyrrolidin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-N-(4-chlorophenyl)-2-cyano-3-[5-nitro-2-(1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(5-nitro-2-pyrrolidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(5-nitro-2-pyrrolidino-phenyl)acrylamide Formula: C20H17ClN4O3 MolecularWeight: 396.82698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C=C(C#N)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H17ClN4O3/c21-16-3-5-17(6-4-16)23-20(26)15(13-22)11-14-12-18(25(27)28)7-8-19(14)24-9-1-2-10-24/h3-8,11-12H,1-2,9-10H2,(H,23,26)/b15-11+