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

Systemtic Name: 1-[4-(4-bromanyl-2-methyl-phenoxy)butyl]piperazine; ethanedioic acid Openeye Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperazine; oxalic acid CAS Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperazine; oxalic acid IUPAC Name: 1-[4-(4-bromo-2-methylphenoxy)butyl]piperazine; oxalic acid Traditional Name: 1-[4-(4-bromo-2-methyl-phenoxy)butyl]piperazine; oxalic acid Formula: C17H25BrN2O5 MolecularWeight: 417.2948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCCN2CCNCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCCN2CCNCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23BrN2O.C2H2O4/c1-13-12-14(16)4-5-15(13)19-11-3-2-8-18-9-6-17-7-10-18;3-1(4)2(5)6/h4-5,12,17H,2-3,6-11H2,1H3;(H,3,4)(H,5,6)