1-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethyl]-3-methyl-piperidine; ethanedioic acid

Systemtic Name: 1-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethyl]-3-methyl-piperidine; ethanedioic acid Openeye Name: 1-[2-(2-bromo-4,6-dimethyl-phenoxy)ethyl]-3-methyl-piperidine; oxalic acid CAS Name: 1-[2-(2-bromo-4,6-dimethylphenoxy)ethyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[2-(2-bromo-4,6-dimethylphenoxy)ethyl]-3-methylpiperidine; oxalic acid Traditional Name: 1-[2-(2-bromo-4,6-dimethyl-phenoxy)ethyl]-3-methyl-piperidine; oxalic acid Formula: C18H26BrNO5 MolecularWeight: 416.30674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCOC2=C(C=C(C=C2Br)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)CCOC2=C(C=C(C=C2Br)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24BrNO.C2H2O4/c1-12-5-4-6-18(11-12)7-8-19-16-14(3)9-13(2)10-15(16)17;3-1(4)2(5)6/h9-10,12H,4-8,11H2,1-3H3;(H,3,4)(H,5,6)