3-(2-tert-butyl-4-chloranyl-phenoxy)-N-methyl-propan-1-amine; ethanedioic acid

Systemtic Name: 3-(2-tert-butyl-4-chloranyl-phenoxy)-N-methyl-propan-1-amine; ethanedioic acid Openeye Name: 3-(2-tert-butyl-4-chloro-phenoxy)-N-methyl-propan-1-amine; oxalic acid CAS Name: 3-(2-tert-butyl-4-chlorophenoxy)-N-methyl-1-propanamine; oxalic acid IUPAC Name: 3-(2-tert-butyl-4-chlorophenoxy)-N-methylpropan-1-amine; oxalic acid Traditional Name: 3-(2-tert-butyl-4-chloro-phenoxy)propyl-methyl-amine; oxalic acid Formula: C16H24ClNO5 MolecularWeight: 345.81846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22ClNO.C2H2O4/c1-14(2,3)12-10-11(15)6-7-13(12)17-9-5-8-16-4;3-1(4)2(5)6/h6-7,10,16H,5,8-9H2,1-4H3;(H,3,4)(H,5,6)