3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(1,3-dioxoisoindolin-2-yl)propanoic acid CAS Name: 3-(1,3-dioxo-2-isoindolyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-phthalimido-propionic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)O

InChI

InChI=1S/C16H18N2O6/c1-16(2,3)24-15(23)17-11(14(21)22)8-18-12(19)9-6-4-5-7-10(9)13(18)20/h4-7,11H,8H2,1-3H3,(H,17,23)(H,21,22)