4-cyano-4-[[3-cyclohexyl-2-(morpholin-4-ylcarbonylamino)propanoyl]amino]piperidine-1-carboxylic acid

Systemtic Name: 4-cyano-4-[[3-cyclohexyl-2-(morpholin-4-ylcarbonylamino)propanoyl]amino]piperidine-1-carboxylic acid Openeye Name: 4-cyano-4-[[3-cyclohexyl-2-(morpholine-4-carbonylamino)propanoyl]amino]piperidine-1-carboxylic acid CAS Name: 4-cyano-4-[[3-cyclohexyl-2-[[4-morpholinyl(oxo)methyl]amino]-1-oxopropyl]amino]-1-piperidinecarboxylic acid IUPAC Name: 4-cyano-4-[[3-cyclohexyl-2-(morpholine-4-carbonylamino)propanoyl]amino]piperidine-1-carboxylic acid Traditional Name: 4-cyano-4-[[3-cyclohexyl-2-(morpholine-4-carbonylamino)propanoyl]amino]piperidine-1-carboxylic acid Formula: C21H33N5O5 MolecularWeight: 435.51722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CCN(CC2)C(=O)O)C#N)NC(=O)N3CCOCC3

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CCN(CC2)C(=O)O)C#N)NC(=O)N3CCOCC3

InChI

InChI=1S/C21H33N5O5/c22-15-21(6-8-26(9-7-21)20(29)30)24-18(27)17(14-16-4-2-1-3-5-16)23-19(28)25-10-12-31-13-11-25/h16-17H,1-14H2,(H,23,28)(H,24,27)(H,29,30)