2-[[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methyl-pyridin-3-yl]methyl]-2-methyl-propanedioic acid

Systemtic Name: 2-[[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methyl-pyridin-3-yl]methyl]-2-methyl-propanedioic acid Openeye Name: 2-[[6-[bis(tert-butoxycarbonyl)amino]-5-methyl-3-pyridyl]methyl]-2-methyl-propanedioic acid CAS Name: 2-[[6-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-methyl-3-pyridinyl]methyl]-2-methylpropanedioic acid IUPAC Name: 2-[[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-methylpyridin-3-yl]methyl]-2-methylpropanedioic acid Traditional Name: 2-[[6-[bis(tert-butoxycarbonyl)amino]-5-methyl-3-pyridyl]methyl]-2-methyl-malonic acid Formula: C21H30N2O8 MolecularWeight: 438.4715

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O8/c1-12-9-13(10-21(8,15(24)25)16(26)27)11-22-14(12)23(17(28)30-19(2,3)4)18(29)31-20(5,6)7/h9,11H,10H2,1-8H3,(H,24,25)(H,26,27)