ethanedioic acid; icosanedinitrile

Systemtic Name: ethanedioic acid; icosanedinitrile Openeye Name: icosanedinitrile; oxalic acid CAS Name: eicosanedinitrile; oxalic acid IUPAC Name: icosanedinitrile; oxalic acid Traditional Name: eicosanedinitrile; oxalic acid Formula: C22H38N2O4 MolecularWeight: 394.54812

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCCC#N)CCCCCCCCC#N.C(=O)(C(=O)O)O

Isomeric SMILES

C(CCCCCCCCCC#N)CCCCCCCCC#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H36N2.C2H2O4/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22;3-1(4)2(5)6/h1-18H2;(H,3,4)(H,5,6)