1-[2-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]ethyl]piperazine; ethanedioic acid

Systemtic Name: 1-[2-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]ethyl]piperazine; ethanedioic acid Openeye Name: 1-[2-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]ethyl]piperazine; oxalic acid CAS Name: 1-[2-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]ethyl]piperazine; oxalic acid IUPAC Name: 1-[2-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]ethyl]piperazine; oxalic acid Traditional Name: 1-[2-(4-tert-amyl-2-chloro-phenoxy)ethyl]piperazine; oxalic acid Formula: C19H29ClN2O5 MolecularWeight: 400.89696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCN2CCNCC2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCN2CCNCC2)Cl.C(=O)(C(=O)O)O

InChI

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