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

Systemtic Name: 1-[2-(2-bromanyl-4-methyl-phenoxy)ethyl]piperidine; ethanedioic acid Openeye Name: 1-[2-(2-bromo-4-methyl-phenoxy)ethyl]piperidine; oxalic acid CAS Name: 1-[2-(2-bromo-4-methylphenoxy)ethyl]piperidine; oxalic acid IUPAC Name: 1-[2-(2-bromo-4-methylphenoxy)ethyl]piperidine; oxalic acid Traditional Name: 1-[2-(2-bromo-4-methyl-phenoxy)ethyl]piperidine; oxalic acid Formula: C16H22BrNO5 MolecularWeight: 388.25358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2CCCCC2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2CCCCC2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20BrNO.C2H2O4/c1-12-5-6-14(13(15)11-12)17-10-9-16-7-3-2-4-8-16;3-1(4)2(5)6/h5-6,11H,2-4,7-10H2,1H3;(H,3,4)(H,5,6)