ethanedioic acid; 1-ethyl-4-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]piperazine

Systemtic Name: ethanedioic acid; 1-ethyl-4-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]piperazine Openeye Name: 1-ethyl-4-[4-(4-isopropyl-3-methyl-phenoxy)butyl]piperazine; oxalic acid CAS Name: 1-ethyl-4-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]piperazine; oxalic acid IUPAC Name: 1-ethyl-4-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]piperazine; oxalic acid Traditional Name: 1-ethyl-4-[4-(4-isopropyl-3-methyl-phenoxy)butyl]piperazine; oxalic acid Formula: C22H36N2O5 MolecularWeight: 408.53164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCCOC2=CC(=C(C=C2)C(C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCCOC2=CC(=C(C=C2)C(C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H34N2O.C2H2O4/c1-5-21-11-13-22(14-12-21)10-6-7-15-23-19-8-9-20(17(2)3)18(4)16-19;3-1(4)2(5)6/h8-9,16-17H,5-7,10-15H2,1-4H3;(H,3,4)(H,5,6)