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

Systemtic Name: 1-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]-3-methyl-piperidine; ethanedioic acid Openeye Name: 1-[3-(2-bromo-4-chloro-phenoxy)propyl]-3-methyl-piperidine; oxalic acid CAS Name: 1-[3-(2-bromo-4-chlorophenoxy)propyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[3-(2-bromo-4-chlorophenoxy)propyl]-3-methylpiperidine; oxalic acid Traditional Name: 1-[3-(2-bromo-4-chloro-phenoxy)propyl]-3-methyl-piperidine; oxalic acid Formula: C17H23BrClNO5 MolecularWeight: 436.72522

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCOC2=C(C=C(C=C2)Cl)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)CCCOC2=C(C=C(C=C2)Cl)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H21BrClNO.C2H2O4/c1-12-4-2-7-18(11-12)8-3-9-19-15-6-5-13(17)10-14(15)16;3-1(4)2(5)6/h5-6,10,12H,2-4,7-9,11H2,1H3;(H,3,4)(H,5,6)