ethanedioic acid; 4-morpholin-4-yl-2,2-diphenyl-butanenitrile

Systemtic Name: ethanedioic acid; 4-morpholin-4-yl-2,2-diphenyl-butanenitrile Openeye Name: 4-morpholino-2,2-diphenyl-butanenitrile; oxalic acid CAS Name: 4-(4-morpholinyl)-2,2-diphenylbutanenitrile; oxalic acid IUPAC Name: 4-morpholin-4-yl-2,2-diphenylbutanenitrile; oxalic acid Traditional Name: 4-morpholino-2,2-diphenyl-butyronitrile; oxalic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1COCCN1CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H22N2O.C2H2O4/c21-17-20(18-7-3-1-4-8-18,19-9-5-2-6-10-19)11-12-22-13-15-23-16-14-22;3-1(4)2(5)6/h1-10H,11-16H2;(H,3,4)(H,5,6)