N-(cyanomethyl)-1-[3-[3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]phenyl]piperidine-2-carboxamide

Systemtic Name: N-(cyanomethyl)-1-[3-[3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]phenyl]piperidine-2-carboxamide Openeye Name: N-(cyanomethyl)-1-[3-[3-(4-morpholino-1-piperidyl)phenyl]phenyl]piperidine-2-carboxamide CAS Name: N-(cyanomethyl)-1-[3-[3-[4-(4-morpholinyl)-1-piperidinyl]phenyl]phenyl]-2-piperidinecarboxamide IUPAC Name: N-(cyanomethyl)-1-[3-[3-(4-morpholin-4-ylpiperidin-1-yl)phenyl]phenyl]piperidine-2-carboxamide Traditional Name: N-(cyanomethyl)-1-[3-[3-(4-morpholinopiperidino)phenyl]phenyl]pipecolinamide Formula: C29H37N5O2 MolecularWeight: 487.63638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NCC#N)C2=CC=CC(=C2)C3=CC(=CC=C3)N4CCC(CC4)N5CCOCC5

Isomeric SMILES

C1CCN(C(C1)C(=O)NCC#N)C2=CC=CC(=C2)C3=CC(=CC=C3)N4CCC(CC4)N5CCOCC5

InChI

InChI=1S/C29H37N5O2/c30-12-13-31-29(35)28-9-1-2-14-34(28)27-8-4-6-24(22-27)23-5-3-7-26(21-23)32-15-10-25(11-16-32)33-17-19-36-20-18-33/h3-8,21-22,25,28H,1-2,9-11,13-20H2,(H,31,35)