4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzamide

Systemtic Name: 4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzamide Openeye Name: 4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzamide CAS Name: 4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]-1-pyrrolidin-1-iumyl]benzamide IUPAC Name: 4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzamide Traditional Name: 4-cyano-N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzamide Formula: C28H27N4O2+ MolecularWeight: 451.53958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC[N+](C1)(CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H26N4O2/c29-20-22-4-8-24(9-5-22)25-12-14-27(15-13-25)34-19-3-18-32(16-1-2-17-32)31-28(33)26-10-6-23(21-30)7-11-26/h4-15H,1-3,16-19H2/p+1