3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; ethanedioic acid

Systemtic Name: 3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; ethanedioic acid Openeye Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; oxalic acid CAS Name: 3-(2-bromo-6-chloro-4-methylphenoxy)-N-(2-methoxyethyl)-1-propanamine; oxalic acid IUPAC Name: 3-(2-bromo-6-chloro-4-methylphenoxy)-N-(2-methoxyethyl)propan-1-amine; oxalic acid Traditional Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-(2-methoxyethyl)amine; oxalic acid Formula: C15H21BrClNO6 MolecularWeight: 426.68734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrClNO2.C2H2O4/c1-10-8-11(14)13(12(15)9-10)18-6-3-4-16-5-7-17-2;3-1(4)2(5)6/h8-9,16H,3-7H2,1-2H3;(H,3,4)(H,5,6)