1-[3-(4-chloranyl-2,5-dimethyl-phenoxy)propyl]-4-ethyl-piperazine; ethanedioic acid

Systemtic Name: 1-[3-(4-chloranyl-2,5-dimethyl-phenoxy)propyl]-4-ethyl-piperazine; ethanedioic acid Openeye Name: 1-[3-(4-chloro-2,5-dimethyl-phenoxy)propyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-[3-(4-chloro-2,5-dimethylphenoxy)propyl]-4-ethylpiperazine; oxalic acid IUPAC Name: 1-[3-(4-chloro-2,5-dimethylphenoxy)propyl]-4-ethylpiperazine; oxalic acid Traditional Name: 1-[3-(4-chloro-2,5-dimethyl-phenoxy)propyl]-4-ethyl-piperazine; oxalic acid Formula: C19H29ClN2O5 MolecularWeight: 400.89696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCOC2=C(C=C(C(=C2)C)Cl)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCOC2=C(C=C(C(=C2)C)Cl)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27ClN2O.C2H2O4/c1-4-19-7-9-20(10-8-19)6-5-11-21-17-13-14(2)16(18)12-15(17)3;3-1(4)2(5)6/h12-13H,4-11H2,1-3H3;(H,3,4)(H,5,6)