3-[1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: 3-[1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: 2-(tert-butoxycarbonylamino)-3-(1-methyl-2,5-dioxo-pyrrol-3-yl)propanoate CAS Name: 3-(1-methyl-2,5-dioxo-3-pyrrolyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-(1-methyl-2,5-dioxopyrrol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(2,5-diketo-1-methyl-3-pyrrolin-3-yl)propionate Formula: C13H17N2O6- MolecularWeight: 297.28388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=O)N(C1=O)C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC(=O)N(C1=O)C)C(=O)[O-]

InChI

InChI=1S/C13H18N2O6/c1-13(2,3)21-12(20)14-8(11(18)19)5-7-6-9(16)15(4)10(7)17/h6,8H,5H2,1-4H3,(H,14,20)(H,18,19)/p-1