2-cyclopentyl-2-phenyl-4-piperidin-1-yl-butanenitrile; ethanedioic acid

Systemtic Name: 2-cyclopentyl-2-phenyl-4-piperidin-1-yl-butanenitrile; ethanedioic acid Openeye Name: 2-cyclopentyl-2-phenyl-4-(1-piperidyl)butanenitrile; oxalic acid CAS Name: 2-cyclopentyl-2-phenyl-4-(1-piperidinyl)butanenitrile; oxalic acid IUPAC Name: 2-cyclopentyl-2-phenyl-4-piperidin-1-ylbutanenitrile; oxalic acid Traditional Name: 2-cyclopentyl-2-phenyl-4-piperidino-butyronitrile; oxalic acid Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(C#N)(C2CCCC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCC(C#N)(C2CCCC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H28N2.C2H2O4/c21-17-20(19-11-5-6-12-19,18-9-3-1-4-10-18)13-16-22-14-7-2-8-15-22;3-1(4)2(5)6/h1,3-4,9-10,19H,2,5-8,11-16H2;(H,3,4)(H,5,6)