1-[4-(2-bromanyl-4-chloranyl-phenoxy)butyl]-3-methyl-piperidine; ethanedioic acid

Systemtic Name: 1-[4-(2-bromanyl-4-chloranyl-phenoxy)butyl]-3-methyl-piperidine; ethanedioic acid Openeye Name: 1-[4-(2-bromo-4-chloro-phenoxy)butyl]-3-methyl-piperidine; oxalic acid CAS Name: 1-[4-(2-bromo-4-chlorophenoxy)butyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[4-(2-bromo-4-chlorophenoxy)butyl]-3-methylpiperidine; oxalic acid Traditional Name: 1-[4-(2-bromo-4-chloro-phenoxy)butyl]-3-methyl-piperidine; oxalic acid Formula: C18H25BrClNO5 MolecularWeight: 450.7518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCCOC2=C(C=C(C=C2)Cl)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)CCCCOC2=C(C=C(C=C2)Cl)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23BrClNO.C2H2O4/c1-13-5-4-9-19(12-13)8-2-3-10-20-16-7-6-14(18)11-15(16)17;3-1(4)2(5)6/h6-7,11,13H,2-5,8-10,12H2,1H3;(H,3,4)(H,5,6)