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

Systemtic Name: 1-[4-(2-tert-butyl-4-chloranyl-phenoxy)butyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[4-(2-tert-butyl-4-chloro-phenoxy)butyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[4-(2-tert-butyl-4-chlorophenoxy)butyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[4-(2-tert-butyl-4-chlorophenoxy)butyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[4-(2-tert-butyl-4-chloro-phenoxy)butyl]-4-methyl-piperazine; oxalic acid Formula: C21H33ClN2O5 MolecularWeight: 428.95012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31ClN2O.C2H2O4/c1-19(2,3)17-15-16(20)7-8-18(17)23-14-6-5-9-22-12-10-21(4)11-13-22;3-1(4)2(5)6/h7-8,15H,5-6,9-14H2,1-4H3;(H,3,4)(H,5,6)