ethanedioic acid; 1-[4-[3-iodanylpropyl(methyl)amino]but-2-ynyl]pyrrolidin-2-one

Systemtic Name: ethanedioic acid; 1-[4-[3-iodanylpropyl(methyl)amino]but-2-ynyl]pyrrolidin-2-one Openeye Name: 1-[4-[3-iodopropyl(methyl)amino]but-2-ynyl]pyrrolidin-2-one; oxalic acid CAS Name: 1-[4-[3-iodopropyl(methyl)amino]but-2-ynyl]-2-pyrrolidinone; oxalic acid IUPAC Name: 1-[4-[3-iodopropyl(methyl)amino]but-2-ynyl]pyrrolidin-2-one; oxalic acid Traditional Name: 1-[4-[3-iodopropyl(methyl)amino]but-2-ynyl]-2-pyrrolidone; oxalic acid Formula: C14H21IN2O5 MolecularWeight: 424.23141

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCI)CC#CCN1CCCC1=O.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCCI)CC#CCN1CCCC1=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H19IN2O.C2H2O4/c1-14(9-5-7-13)8-2-3-10-15-11-4-6-12(15)16;3-1(4)2(5)6/h4-11H2,1H3;(H,3,4)(H,5,6)