ethyl 1-[3-[furan-2-ylmethyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[furan-2-ylmethyl(pyrazin-2-ylcarbonyl)amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[2-furylmethyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[3-[2-furanylmethyl-[oxo(2-pyrazinyl)methyl]amino]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[furan-2-ylmethyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[2-furfuryl(pyrazinoyl)amino]propanoyl]isonipecotic acid ethyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN(CC2=CC=CO2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN(CC2=CC=CO2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H26N4O5/c1-2-29-21(28)16-5-10-24(11-6-16)19(26)7-12-25(15-17-4-3-13-30-17)20(27)18-14-22-8-9-23-18/h3-4,8-9,13-14,16H,2,5-7,10-12,15H2,1H3