4-phenyl-N-[4-[[4-(2-phenylethynyl)cyclohex-3-en-1-yl]-propyl-amino]butyl]benzamide

Systemtic Name: 4-phenyl-N-[4-[[4-(2-phenylethynyl)cyclohex-3-en-1-yl]-propyl-amino]butyl]benzamide Openeye Name: 4-phenyl-N-[4-[[4-(2-phenylethynyl)cyclohex-3-en-1-yl]-propyl-amino]butyl]benzamide CAS Name: 4-phenyl-N-[4-[[4-(2-phenylethynyl)-1-cyclohex-3-enyl]-propylamino]butyl]benzamide IUPAC Name: 4-phenyl-N-[4-[[4-(2-phenylethynyl)cyclohex-3-en-1-yl]-propylamino]butyl]benzamide Traditional Name: 4-phenyl-N-[4-[[4-(2-phenylethynyl)cyclohex-3-en-1-yl]-propyl-amino]butyl]benzamide Formula: C34H38N2O MolecularWeight: 490.67832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCNC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)C3CCC(=CC3)C#CC4=CC=CC=C4

Isomeric SMILES

CCCN(CCCCNC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)C3CCC(=CC3)C#CC4=CC=CC=C4

InChI

InChI=1S/C34H38N2O/c1-2-26-36(33-23-17-29(18-24-33)16-15-28-11-5-3-6-12-28)27-10-9-25-35-34(37)32-21-19-31(20-22-32)30-13-7-4-8-14-30/h3-8,11-14,17,19-22,33H,2,9-10,18,23-27H2,1H3,(H,35,37)