4-(diethylamino)-2-phenyl-butanenitrile; ethanedioate

Systemtic Name: 4-(diethylamino)-2-phenyl-butanenitrile; ethanedioate Openeye Name: 4-(diethylamino)-2-phenyl-butanenitrile; oxalate CAS Name: 4-(diethylamino)-2-phenylbutanenitrile; oxalate IUPAC Name: 4-(diethylamino)-2-phenylbutanenitrile; oxalate Traditional Name: 4-(diethylamino)-2-phenyl-butyronitrile; oxalate Formula: C16H20N2O4-2 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(C#N)C1=CC=CC=C1.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CCN(CC)CCC(C#N)C1=CC=CC=C1.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C14H20N2.C2H2O4/c1-3-16(4-2)11-10-14(12-15)13-8-6-5-7-9-13;3-1(4)2(5)6/h5-9,14H,3-4,10-11H2,1-2H3;(H,3,4)(H,5,6)/p-2