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

Systemtic Name: ethanedioic acid; 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazine Openeye Name: 1-[4-[4-(1,1-dimethylpropyl)phenoxy]butyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazine; oxalic acid IUPAC Name: 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazine; oxalic acid Traditional Name: 1-[4-(4-tert-amylphenoxy)butyl]-4-methyl-piperazine; oxalic acid Formula: C22H36N2O5 MolecularWeight: 408.53164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCCCN2CCN(CC2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCCCN2CCN(CC2)C.C(=O)(C(=O)O)O

InChI

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