N-[4-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]morpholine-4-carboxamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]morpholine-4-carboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]morpholine-4-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-4-morpholinecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]morpholine-4-carboxamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]morpholine-4-carboxamide Formula: C25H38N4O3 MolecularWeight: 442.59422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)N3CCOCC3)C4CCC(CC4)N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)N3CCOCC3)C4CCC(CC4)N

InChI

InChI=1S/C25H38N4O3/c26-21-8-12-23(13-9-21)29(24(30)20-4-2-1-3-5-20)18-19-6-10-22(11-7-19)27-25(31)28-14-16-32-17-15-28/h6-7,10-11,20-21,23H,1-5,8-9,12-18,26H2,(H,27,31)