3-(4-aminocarbonylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid

Systemtic Name: 3-(4-aminocarbonylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-3-(4-carbamoylphenyl)-2-hydroxy-propanoic acid CAS Name: 3-(4-carbamoylphenyl)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-carbamoylphenyl)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-3-(4-carbamoylphenyl)-2-hydroxy-propionic acid Formula: C15H20N2O6 MolecularWeight: 324.3291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O6/c1-15(2,3)23-14(22)17-10(11(18)13(20)21)8-4-6-9(7-5-8)12(16)19/h4-7,10-11,18H,1-3H3,(H2,16,19)(H,17,22)(H,20,21)