ethyl 1-[3-[pentyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[pentyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[pentyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-[[oxo(2-pyrazinyl)methyl]-pentylamino]propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[pentyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[amyl(pyrazinoyl)amino]propanoyl]nipecotic acid ethyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC(=O)N1CCCC(C1)C(=O)OCC)C(=O)C2=NC=CN=C2

Isomeric SMILES

CCCCCN(CCC(=O)N1CCCC(C1)C(=O)OCC)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C21H32N4O4/c1-3-5-6-12-24(20(27)18-15-22-10-11-23-18)14-9-19(26)25-13-7-8-17(16-25)21(28)29-4-2/h10-11,15,17H,3-9,12-14,16H2,1-2H3