1-[2-(2-tert-butyl-4-chloranyl-phenoxy)ethyl]-4-methyl-piperazine; ethanedioic acid

Systemtic Name: 1-[2-(2-tert-butyl-4-chloranyl-phenoxy)ethyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[2-(2-tert-butyl-4-chloro-phenoxy)ethyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[2-(2-tert-butyl-4-chlorophenoxy)ethyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[2-(2-tert-butyl-4-chlorophenoxy)ethyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[2-(2-tert-butyl-4-chloro-phenoxy)ethyl]-4-methyl-piperazine; oxalic acid Formula: C19H29ClN2O5 MolecularWeight: 400.89696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCN2CCN(CC2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCN2CCN(CC2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27ClN2O.C2H2O4/c1-17(2,3)15-13-14(18)5-6-16(15)21-12-11-20-9-7-19(4)8-10-20;3-1(4)2(5)6/h5-6,13H,7-12H2,1-4H3;(H,3,4)(H,5,6)