3-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate

Systemtic Name: 3-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate Openeye Name: 3-acetylsulfanyl-2-(tert-butoxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-(acetylthio)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: 3-acetylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate Traditional Name: 3-(acetylthio)-2-(tert-butoxycarbonylamino)-3-phenyl-propionate Formula: C16H20NO5S- MolecularWeight: 338.3987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C1=CC=CC=C1)C(C(=O)[O-])NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SC(C1=CC=CC=C1)C(C(=O)[O-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H21NO5S/c1-10(18)23-13(11-8-6-5-7-9-11)12(14(19)20)17-15(21)22-16(2,3)4/h5-9,12-13H,1-4H3,(H,17,21)(H,19,20)/p-1