ethyl (2R)-2-cyano-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylimino]propanoate

Systemtic Name: ethyl (2R)-2-cyano-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylimino]propanoate Openeye Name: ethyl (2R)-2-cyano-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylimino]propanoate CAS Name: (2R)-2-cyano-3-[[1-(4-morpholin-4-iumyl)cyclohexyl]methylimino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-cyano-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylimino]propanoate Traditional Name: (2R)-2-cyano-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylimino]propionic acid ethyl ester Formula: C17H28N3O3+ MolecularWeight: 322.42252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCC1(CCCCC1)[NH+]2CCOCC2)C#N

Isomeric SMILES

CCOC(=O)[C@H](C=NCC1(CCCCC1)[NH+]2CCOCC2)C#N

InChI

InChI=1S/C17H27N3O3/c1-2-23-16(21)15(12-18)13-19-14-17(6-4-3-5-7-17)20-8-10-22-11-9-20/h13,15H,2-11,14H2,1H3/p+1/t15-/m0/s1