1-[2-chloranyl-5-(4-propanoylphenyl)phenyl]-N-(cyanomethyl)-4-methyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[2-chloranyl-5-(4-propanoylphenyl)phenyl]-N-(cyanomethyl)-4-methyl-pyrrolidine-2-carboxamide Openeye Name: 1-[2-chloro-5-(4-propanoylphenyl)phenyl]-N-(cyanomethyl)-4-methyl-pyrrolidine-2-carboxamide CAS Name: 1-[2-chloro-5-[4-(1-oxopropyl)phenyl]phenyl]-N-(cyanomethyl)-4-methyl-2-pyrrolidinecarboxamide IUPAC Name: 1-[2-chloro-5-(4-propanoylphenyl)phenyl]-N-(cyanomethyl)-4-methylpyrrolidine-2-carboxamide Traditional Name: 1-[2-chloro-5-(4-propionylphenyl)phenyl]-N-(cyanomethyl)-4-methyl-pyrrolidine-2-carboxamide Formula: C23H24ClN3O2 MolecularWeight: 409.90856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)N3CC(CC3C(=O)NCC#N)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)N3CC(CC3C(=O)NCC#N)C

InChI

InChI=1S/C23H24ClN3O2/c1-3-22(28)17-6-4-16(5-7-17)18-8-9-19(24)20(13-18)27-14-15(2)12-21(27)23(29)26-11-10-25/h4-9,13,15,21H,3,11-12,14H2,1-2H3,(H,26,29)