diethyl 1-[(2-iodanylphenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2,4-dicarboxylate

Systemtic Name: diethyl 1-[(2-iodanylphenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2,4-dicarboxylate Openeye Name: diethyl 4-(tert-butoxycarbonylamino)-1-[(2-iodophenyl)methyl]pyrrolidine-2,4-dicarboxylate CAS Name: 1-[(2-iodophenyl)methyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pyrrolidine-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[(2-iodophenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2,4-dicarboxylate Traditional Name: 4-(tert-butoxycarbonylamino)-1-(2-iodobenzyl)pyrrolidine-2,4-dicarboxylic acid diethyl ester Formula: C22H31IN2O6 MolecularWeight: 546.39581

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CN1CC2=CC=CC=C2I)(C(=O)OCC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1CC(CN1CC2=CC=CC=C2I)(C(=O)OCC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H31IN2O6/c1-6-29-18(26)17-12-22(19(27)30-7-2,24-20(28)31-21(3,4)5)14-25(17)13-15-10-8-9-11-16(15)23/h8-11,17H,6-7,12-14H2,1-5H3,(H,24,28)