methyl (2S)-3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-2-(2-methylbutan-2-yloxycarbonylamino)propanoate

Systemtic Name: methyl (2S)-3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-2-(2-methylbutan-2-yloxycarbonylamino)propanoate Openeye Name: methyl (2S)-3-(4-benzyloxy-2,6-dimethyl-phenyl)-2-(1,1-dimethylpropoxycarbonylamino)propanoate CAS Name: (2S)-3-(2,6-dimethyl-4-phenylmethoxyphenyl)-2-[[2-methylbutan-2-yloxy(oxo)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(2,6-dimethyl-4-phenylmethoxyphenyl)-2-(2-methylbutan-2-yloxycarbonylamino)propanoate Traditional Name: (2S)-2-(tert-amyloxycarbonylamino)-3-(4-benzoxy-2,6-dimethyl-phenyl)propionic acid methyl ester Formula: C25H33NO5 MolecularWeight: 427.53322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC(=O)NC(CC1=C(C=C(C=C1C)OCC2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CCC(C)(C)OC(=O)N[C@@H](CC1=C(C=C(C=C1C)OCC2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C25H33NO5/c1-7-25(4,5)31-24(28)26-22(23(27)29-6)15-21-17(2)13-20(14-18(21)3)30-16-19-11-9-8-10-12-19/h8-14,22H,7,15-16H2,1-6H3,(H,26,28)/t22-/m0/s1