3-(4-ethanoylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoate

Systemtic Name: 3-(4-ethanoylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoate Openeye Name: 3-(4-acetylphenyl)-3-(tert-butoxycarbonylamino)-2-hydroxy-propanoate CAS Name: 3-(4-acetylphenyl)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-(4-acetylphenyl)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(4-acetylphenyl)-3-(tert-butoxycarbonylamino)-2-hydroxy-propionate Formula: C16H20NO6- MolecularWeight: 322.3331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO6/c1-9(18)10-5-7-11(8-6-10)12(13(19)14(20)21)17-15(22)23-16(2,3)4/h5-8,12-13,19H,1-4H3,(H,17,22)(H,20,21)/p-1