ethanedioic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]piperidin-2-yl]pyridine

Systemtic Name: ethanedioic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]piperidin-2-yl]pyridine Openeye Name: oxalic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]-2-piperidyl]pyridine CAS Name: oxalic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]-2-piperidinyl]pyridine IUPAC Name: oxalic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]piperidin-2-yl]pyridine Traditional Name: oxalic acid; 3-[1-[3-(3-phenoxyphenoxy)propyl]-2-piperidyl]pyridine Formula: C27H30N2O6 MolecularWeight: 478.5369

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)CCCOC3=CC=CC(=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)CCCOC3=CC=CC(=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H28N2O2.C2H2O4/c1-2-10-22(11-3-1)29-24-13-6-12-23(19-24)28-18-8-17-27-16-5-4-14-25(27)21-9-7-15-26-20-21;3-1(4)2(5)6/h1-3,6-7,9-13,15,19-20,25H,4-5,8,14,16-18H2;(H,3,4)(H,5,6)