dimethyl (1R,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-dihydroisoindole-1,3-dicarboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(C2=CC=CC=C2C1C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NN1[C@H](C2=CC=CC=C2[C@@H]1C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H22N2O6/c1-17(2,3)25-16(22)18-19-12(14(20)23-4)10-8-6-7-9-11(10)13(19)15(21)24-5/h6-9,12-13H,1-5H3,(H,18,22)/t12-,13-/m1/s1