ethyl 3-acetamido-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-acetamido-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]propanoate Openeye Name: ethyl 3-acetamido-3-[[1-[3-(4-piperidyl)propanoyl]piperidine-3-carbonyl]amino]propanoate CAS Name: 3-acetamido-3-[[oxo-[1-[1-oxo-3-(4-piperidinyl)propyl]-3-piperidinyl]methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-acetamido-3-[[1-(3-piperidin-4-ylpropanoyl)piperidine-3-carbonyl]amino]propanoate Traditional Name: 3-acetamido-3-[[1-[3-(4-piperidyl)propanoyl]nipecotoyl]amino]propionic acid ethyl ester Formula: C21H36N4O5 MolecularWeight: 424.53434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(NC(=O)C)NC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2

Isomeric SMILES

CCOC(=O)CC(NC(=O)C)NC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2

InChI

InChI=1S/C21H36N4O5/c1-3-30-20(28)13-18(23-15(2)26)24-21(29)17-5-4-12-25(14-17)19(27)7-6-16-8-10-22-11-9-16/h16-18,22H,3-14H2,1-2H3,(H,23,26)(H,24,29)