(2R)-3-[(3,4-dimethylphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (2R)-3-[(3,4-dimethylphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(3,4-dimethylphenyl)methylsulfanyl]propanoate CAS Name: (2R)-3-[(3,4-dimethylphenyl)methylthio]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: (2R)-3-[(3,4-dimethylphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(3,4-dimethylbenzyl)thio]propionate Formula: C17H24NO4S- MolecularWeight: 338.44176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CSCC(C(=O)[O-])NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CSC[C@@H](C(=O)[O-])NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H25NO4S/c1-11-6-7-13(8-12(11)2)9-23-10-14(15(19)20)18-16(21)22-17(3,4)5/h6-8,14H,9-10H2,1-5H3,(H,18,21)(H,19,20)/p-1/t14-/m0/s1