ethanedioic acid; (2S)-1-[2-[2-(2-oxidanylidene-3-propan-2-yl-imidazolidin-1-yl)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: ethanedioic acid; (2S)-1-[2-[2-(2-oxidanylidene-3-propan-2-yl-imidazolidin-1-yl)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[2-[2-(3-isopropyl-2-oxo-imidazolidin-1-yl)ethylamino]acetyl]pyrrolidine-2-carbonitrile; oxalic acid CAS Name: oxalic acid; (2S)-1-[1-oxo-2-[2-(2-oxo-3-propan-2-yl-1-imidazolidinyl)ethylamino]ethyl]-2-pyrrolidinecarbonitrile IUPAC Name: oxalic acid; (2S)-1-[2-[2-(2-oxo-3-propan-2-ylimidazolidin-1-yl)ethylamino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[2-[2-(3-isopropyl-2-keto-imidazolidin-1-yl)ethylamino]acetyl]pyrrolidine-2-carbonitrile; oxalic acid Formula: C17H27N5O6 MolecularWeight: 397.42618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(C1=O)CCNCC(=O)N2CCCC2C#N.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N1CCN(C1=O)CCNCC(=O)N2CCC[C@H]2C#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25N5O2.C2H2O4/c1-12(2)19-9-8-18(15(19)22)7-5-17-11-14(21)20-6-3-4-13(20)10-16;3-1(4)2(5)6/h12-13,17H,3-9,11H2,1-2H3;(H,3,4)(H,5,6)/t13-;/m0./s1