2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(pyridin-2-ylmethyl)propanedioic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(pyridin-2-ylmethyl)propanedioic acid Openeye Name: 2-(tert-butoxycarbonylamino)-2-(2-pyridylmethyl)propanedioic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(2-pyridinylmethyl)propanedioic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(pyridin-2-ylmethyl)propanedioic acid Traditional Name: 2-(tert-butoxycarbonylamino)-2-(2-pyridylmethyl)malonic acid Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=N1)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=N1)(C(=O)O)C(=O)O

InChI

InChI=1S/C14H18N2O6/c1-13(2,3)22-12(21)16-14(10(17)18,11(19)20)8-9-6-4-5-7-15-9/h4-7H,8H2,1-3H3,(H,16,21)(H,17,18)(H,19,20)