ethanedioic acid; 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine

Systemtic Name: ethanedioic acid; 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine Openeye Name: 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine; oxalic acid CAS Name: 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine; oxalic acid IUPAC Name: 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine; oxalic acid Traditional Name: 1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine; oxalic acid Formula: C21H34N2O5 MolecularWeight: 394.50506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCCOC2=CC(=CC(=C2C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCCOC2=CC(=CC(=C2C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H32N2O.C2H2O4/c1-5-20-9-11-21(12-10-20)8-6-7-13-22-19-15-16(2)14-17(3)18(19)4;3-1(4)2(5)6/h14-15H,5-13H2,1-4H3;(H,3,4)(H,5,6)