N-decyl-1-[[4-[[3-(decylcarbamoyl)piperidin-1-yl]methyl]phenyl]methyl]piperidine-3-carboxamide dibromide

Systemtic Name: N-decyl-1-[[4-[[3-(decylcarbamoyl)piperidin-1-yl]methyl]phenyl]methyl]piperidine-3-carboxamide dibromide Openeye Name: N-decyl-1-[[4-[[3-(decylcarbamoyl)-1-piperidyl]methyl]phenyl]methyl]piperidine-3-carboxamide dibromide CAS Name: N-decyl-1-[[4-[[3-[(decylamino)-oxomethyl]-1-piperidinyl]methyl]phenyl]methyl]-3-piperidinecarboxamide dibromide IUPAC Name: N-decyl-1-[[4-[[3-(decylcarbamoyl)piperidin-1-yl]methyl]phenyl]methyl]piperidine-3-carboxamide dibromide Traditional Name: N-decyl-1-[4-[[3-(decylcarbamoyl)piperidino]methyl]benzyl]nipecotamide dibromide Formula: C40H70Br2N4O2-2 MolecularWeight: 798.8174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)C1CCCN(C1)CC2=CC=C(C=C2)CN3CCCC(C3)C(=O)NCCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCNC(=O)C1CCCN(C1)CC2=CC=C(C=C2)CN3CCCC(C3)C(=O)NCCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C40H70N4O2.2BrH/c1-3-5-7-9-11-13-15-17-27-41-39(45)37-21-19-29-43(33-37)31-35-23-25-36(26-24-35)32-44-30-20-22-38(34-44)40(46)42-28-18-16-14-12-10-8-6-4-2;;/h23-26,37-38H,3-22,27-34H2,1-2H3,(H,41,45)(H,42,46);2*1H/p-2