ethanedioic acid; [1-(phenylmethyl)piperidin-3-yl]-piperidin-1-yl-methanone

Systemtic Name: ethanedioic acid; [1-(phenylmethyl)piperidin-3-yl]-piperidin-1-yl-methanone Openeye Name: (1-benzyl-3-piperidyl)-(1-piperidyl)methanone; oxalic acid CAS Name: oxalic acid; [1-(phenylmethyl)-3-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: (1-benzylpiperidin-3-yl)-piperidin-1-ylmethanone; oxalic acid Traditional Name: (1-benzyl-3-piperidyl)-piperidino-methanone; oxalic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCCN(C2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCCN(C2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H26N2O.C2H2O4/c21-18(20-12-5-2-6-13-20)17-10-7-11-19(15-17)14-16-8-3-1-4-9-16;3-1(4)2(5)6/h1,3-4,8-9,17H,2,5-7,10-15H2;(H,3,4)(H,5,6)