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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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