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

Systemtic Name: 1-[4-(4-tert-butyl-2-chloranyl-phenoxy)butyl]piperazine; ethanedioic acid Openeye Name: 1-[4-(4-tert-butyl-2-chloro-phenoxy)butyl]piperazine; oxalic acid CAS Name: 1-[4-(4-tert-butyl-2-chlorophenoxy)butyl]piperazine; oxalic acid IUPAC Name: 1-[4-(4-tert-butyl-2-chlorophenoxy)butyl]piperazine; oxalic acid Traditional Name: 1-[4-(4-tert-butyl-2-chloro-phenoxy)butyl]piperazine; oxalic acid Formula: C20H31ClN2O5 MolecularWeight: 414.92354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCCCN2CCNCC2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCCCN2CCNCC2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H29ClN2O.C2H2O4/c1-18(2,3)15-6-7-17(16(19)14-15)22-13-5-4-10-21-11-8-20-9-12-21;3-1(4)2(5)6/h6-7,14,20H,4-5,8-13H2,1-3H3;(H,3,4)(H,5,6)