1-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]piperidine; ethanedioic acid

Systemtic Name: 1-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]piperidine; ethanedioic acid Openeye Name: 1-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]piperidine; oxalic acid CAS Name: 1-[3-(2-tert-butyl-4-chlorophenoxy)propyl]piperidine; oxalic acid IUPAC Name: 1-[3-(2-tert-butyl-4-chlorophenoxy)propyl]piperidine; oxalic acid Traditional Name: 1-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]piperidine; oxalic acid Formula: C20H30ClNO5 MolecularWeight: 399.9089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCCN2CCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCCN2CCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H28ClNO.C2H2O4/c1-18(2,3)16-14-15(19)8-9-17(16)21-13-7-12-20-10-5-4-6-11-20;3-1(4)2(5)6/h8-9,14H,4-7,10-13H2,1-3H3;(H,3,4)(H,5,6)