(4-tert-butylphenyl)methyl (2R)-2-[[(3R)-3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl]amino]propanoate

Systemtic Name: (4-tert-butylphenyl)methyl (2R)-2-[[(3R)-3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl]amino]propanoate Openeye Name: (4-tert-butylphenyl)methyl (2R)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-butanoyl]amino]propanoate CAS Name: (2R)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-1-oxobutyl]amino]propanoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl (2R)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxybutanoyl]amino]propanoate Traditional Name: (2R)-2-[[(3R)-3-amino-4-cyclohexyl-2-hydroxy-butanoyl]amino]propionic acid (4-tert-butylbenzyl) ester Formula: C24H38N2O4 MolecularWeight: 418.56952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)C(C)(C)C)NC(=O)C(C(CC2CCCCC2)N)O

Isomeric SMILES

C[C@H](C(=O)OCC1=CC=C(C=C1)C(C)(C)C)NC(=O)C([C@@H](CC2CCCCC2)N)O

InChI

InChI=1S/C24H38N2O4/c1-16(23(29)30-15-18-10-12-19(13-11-18)24(2,3)4)26-22(28)21(27)20(25)14-17-8-6-5-7-9-17/h10-13,16-17,20-21,27H,5-9,14-15,25H2,1-4H3,(H,26,28)/t16-,20-,21?/m1/s1