ethanedioate; 2-[methyl(phenethyl)amino]ethanenitrile

Systemtic Name: ethanedioate; 2-[methyl(phenethyl)amino]ethanenitrile Openeye Name: 2-[methyl(phenethyl)amino]acetonitrile; oxalate CAS Name: 2-[methyl(phenethyl)amino]acetonitrile; oxalate IUPAC Name: 2-[methyl(phenethyl)amino]acetonitrile; oxalate Traditional Name: 2-[methyl(phenethyl)amino]acetonitrile; oxalate Formula: C13H14N2O4-2 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)CC#N.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC#N.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C11H14N2.C2H2O4/c1-13(10-8-12)9-7-11-5-3-2-4-6-11;3-1(4)2(5)6/h2-6H,7,9-10H2,1H3;(H,3,4)(H,5,6)/p-2