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

Systemtic Name: ethyl 1-[3-[oxolan-2-ylmethyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[pyrazine-2-carbonyl(tetrahydrofuran-2-ylmethyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-[2-oxolanylmethyl-[oxo(2-pyrazinyl)methyl]amino]propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[oxolan-2-ylmethyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[pyrazinoyl(tetrahydrofurfuryl)amino]propanoyl]nipecotic acid ethyl ester Formula: C21H30N4O5 MolecularWeight: 418.4867

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCN(CC2CCCO2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCN(CC2CCCO2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H30N4O5/c1-2-29-21(28)16-5-3-10-24(14-16)19(26)7-11-25(15-17-6-4-12-30-17)20(27)18-13-22-8-9-23-18/h8-9,13,16-17H,2-7,10-12,14-15H2,1H3