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

Systemtic Name: 1-[4-(4-bromanyl-2-methyl-phenoxy)butyl]piperidine; ethanedioic acid Openeye Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperidine; oxalic acid CAS Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperidine; oxalic acid IUPAC Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperidine; oxalic acid Traditional Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperidine; oxalic acid Formula: C18H26BrNO5 MolecularWeight: 416.30674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCCN2CCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCCN2CCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24BrNO.C2H2O4/c1-14-13-15(17)7-8-16(14)19-12-6-5-11-18-9-3-2-4-10-18;3-1(4)2(5)6/h7-8,13H,2-6,9-12H2,1H3;(H,3,4)(H,5,6)