2-(4-tert-butyl-2-chloranyl-phenoxy)-N-methyl-ethanamine; ethanedioic acid

Systemtic Name: 2-(4-tert-butyl-2-chloranyl-phenoxy)-N-methyl-ethanamine; ethanedioic acid Openeye Name: 2-(4-tert-butyl-2-chloro-phenoxy)-N-methyl-ethanamine; oxalic acid CAS Name: 2-(4-tert-butyl-2-chlorophenoxy)-N-methylethanamine; oxalic acid IUPAC Name: 2-(4-tert-butyl-2-chlorophenoxy)-N-methylethanamine; oxalic acid Traditional Name: 2-(4-tert-butyl-2-chloro-phenoxy)ethyl-methyl-amine; oxalic acid Formula: C15H22ClNO5 MolecularWeight: 331.79188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClNO.C2H2O4/c1-13(2,3)10-5-6-12(11(14)9-10)16-8-7-15-4;3-1(4)2(5)6/h5-6,9,15H,7-8H2,1-4H3;(H,3,4)(H,5,6)