ethanedioic acid; 1-[2-oxidanyl-3-(4-phenylphenoxy)propyl]piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; 1-[2-oxidanyl-3-(4-phenylphenoxy)propyl]piperidine-4-carboxamide Openeye Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]piperidine-4-carboxamide; oxalic acid CAS Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]piperidine-4-carboxamide; oxalic acid Traditional Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]isonipecotamide; oxalic acid Formula: C23H28N2O7 MolecularWeight: 444.47762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC(COC2=CC=C(C=C2)C3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1C(=O)N)CC(COC2=CC=C(C=C2)C3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O3.C2H2O4/c22-21(25)18-10-12-23(13-11-18)14-19(24)15-26-20-8-6-17(7-9-20)16-4-2-1-3-5-16;3-1(4)2(5)6/h1-9,18-19,24H,10-15H2,(H2,22,25);(H,3,4)(H,5,6)