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

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-phenoxy)propyl]piperazine; ethanedioic acid Openeye Name: 1-[3-(4-bromo-2-methyl-phenoxy)propyl]piperazine; oxalic acid CAS Name: 1-[3-(4-bromo-2-methylphenoxy)propyl]piperazine; oxalic acid IUPAC Name: 1-[3-(4-bromo-2-methylphenoxy)propyl]piperazine; oxalic acid Traditional Name: 1-[3-(4-bromo-2-methyl-phenoxy)propyl]piperazine; oxalic acid Formula: C16H23BrN2O5 MolecularWeight: 403.26822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCN2CCNCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCN2CCNCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21BrN2O.C2H2O4/c1-12-11-13(15)3-4-14(12)18-10-2-7-17-8-5-16-6-9-17;3-1(4)2(5)6/h3-4,11,16H,2,5-10H2,1H3;(H,3,4)(H,5,6)