8-[3-[(4-cyanophenyl)amino]propyl-methyl-amino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide

Systemtic Name: 8-[3-[(4-cyanophenyl)amino]propyl-methyl-amino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide Openeye Name: 8-[3-(4-cyanoanilino)propyl-methyl-amino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide CAS Name: 8-[3-(4-cyanoanilino)propyl-methylamino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide IUPAC Name: 8-[3-(4-cyanoanilino)propyl-methylamino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide Traditional Name: 8-[3-(4-cyanoanilino)propyl-methyl-amino]-N-hexyl-3-azabicyclo[3.2.1]octane-3-carboxamide Formula: C25H39N5O MolecularWeight: 425.61006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N1CC2CCC(C1)C2N(C)CCCNC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCNC(=O)N1CC2CCC(C1)C2N(C)CCCNC3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H39N5O/c1-3-4-5-6-14-28-25(31)30-18-21-10-11-22(19-30)24(21)29(2)16-7-15-27-23-12-8-20(17-26)9-13-23/h8-9,12-13,21-22,24,27H,3-7,10-11,14-16,18-19H2,1-2H3,(H,28,31)