2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1,3-dihydroisoindole-1,3-dicarboxylic acid

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1,3-dihydroisoindole-1,3-dicarboxylic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)ethyl]isoindoline-1,3-dicarboxylic acid CAS Name: 2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-1,3-dihydroisoindole-1,3-dicarboxylic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1,3-dihydroisoindole-1,3-dicarboxylic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)ethyl]isoindoline-1,3-dicarboxylic acid Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN1C(C2=CC=CC=C2C1C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCN1C(C2=CC=CC=C2C1C(=O)O)C(=O)O

InChI

InChI=1S/C17H22N2O6/c1-17(2,3)25-16(24)18-8-9-19-12(14(20)21)10-6-4-5-7-11(10)13(19)15(22)23/h4-7,12-13H,8-9H2,1-3H3,(H,18,24)(H,20,21)(H,22,23)