3-[4-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[4-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[4-(1-hydroxy-2-methoxy-2-oxo-ethyl)phenyl]propanoic acid CAS Name: 3-[4-(1-hydroxy-2-methoxy-2-oxoethyl)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-(1-hydroxy-2-methoxy-2-oxoethyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-(1-hydroxy-2-keto-2-methoxy-ethyl)phenyl]propionic acid Formula: C17H23NO7 MolecularWeight: 353.36702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(C(=O)OC)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(C(=O)OC)O)C(=O)O

InChI

InChI=1S/C17H23NO7/c1-17(2,3)25-16(23)18-12(14(20)21)9-10-5-7-11(8-6-10)13(19)15(22)24-4/h5-8,12-13,19H,9H2,1-4H3,(H,18,23)(H,20,21)