butan-2-yl (2R)-2-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonylamino]propanoate

Systemtic Name: butan-2-yl (2R)-2-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonylamino]propanoate Openeye Name: sec-butyl (2R)-2-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]amino]propanoate CAS Name: (2R)-2-[[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]-oxomethyl]amino]propanoic acid butan-2-yl ester IUPAC Name: butan-2-yl (2R)-2-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexanecarbonyl]amino]propanoate Traditional Name: (2R)-2-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]amino]propionic acid sec-butyl ester Formula: C18H33NO3 MolecularWeight: 311.45952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C)NC(=O)C1CC(CCC1C(C)C)C

Isomeric SMILES

CCC(C)OC(=O)[C@@H](C)NC(=O)[C@@H]1C[C@@H](CC[C@H]1C(C)C)C

InChI

InChI=1S/C18H33NO3/c1-7-13(5)22-18(21)14(6)19-17(20)16-10-12(4)8-9-15(16)11(2)3/h11-16H,7-10H2,1-6H3,(H,19,20)/t12-,13?,14-,15+,16-/m1/s1