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

Systemtic Name: ethyl (3R)-1-[3-[butyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-[3-[butyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: (3R)-1-[3-[butyl-[oxo(2-pyrazinyl)methyl]amino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[3-[butyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate Traditional Name: (3R)-1-[3-[butyl(pyrazinoyl)amino]propanoyl]nipecotic acid ethyl ester Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCN(CCC(=O)N1CCC[C@H](C1)C(=O)OCC)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C20H30N4O4/c1-3-5-11-23(19(26)17-14-21-9-10-22-17)13-8-18(25)24-12-6-7-16(15-24)20(27)28-4-2/h9-10,14,16H,3-8,11-13,15H2,1-2H3/t16-/m1/s1