ethyl 3-[[5-(tert-butylcarbamoyl)-1-cyclohexyl-4-oxidanylidene-pyridin-3-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[5-(tert-butylcarbamoyl)-1-cyclohexyl-4-oxidanylidene-pyridin-3-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[5-(tert-butylcarbamoyl)-1-cyclohexyl-4-oxo-pyridine-3-carbonyl]amino]propanoate CAS Name: 3-[[[5-[(tert-butylamino)-oxomethyl]-1-cyclohexyl-4-oxo-3-pyridinyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-(tert-butylcarbamoyl)-1-cyclohexyl-4-oxopyridine-3-carbonyl]amino]propanoate Traditional Name: 3-[[5-(tert-butylcarbamoyl)-1-cyclohexyl-4-keto-nicotinoyl]amino]propionic acid ethyl ester Formula: C22H33N3O5 MolecularWeight: 419.51452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC(C)(C)C)C2CCCCC2

Isomeric SMILES

CCOC(=O)CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC(C)(C)C)C2CCCCC2

InChI

InChI=1S/C22H33N3O5/c1-5-30-18(26)11-12-23-20(28)16-13-25(15-9-7-6-8-10-15)14-17(19(16)27)21(29)24-22(2,3)4/h13-15H,5-12H2,1-4H3,(H,23,28)(H,24,29)