1-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]pyrrolidine; ethanedioic acid

Systemtic Name: 1-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]pyrrolidine; ethanedioic acid Openeye Name: 1-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]pyrrolidine; oxalic acid CAS Name: 1-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]pyrrolidine; oxalic acid IUPAC Name: 1-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]pyrrolidine; oxalic acid Traditional Name: 1-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]pyrrolidine; oxalic acid Formula: C16H21BrClNO5 MolecularWeight: 422.69864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCN2CCCC2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCN2CCCC2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H19BrClNO.C2H2O4/c1-11-9-12(15)14(13(16)10-11)18-8-4-7-17-5-2-3-6-17;3-1(4)2(5)6/h9-10H,2-8H2,1H3;(H,3,4)(H,5,6)