4-(4-bromanyl-2,6-dimethyl-phenoxy)-N-methyl-butan-1-amine; ethanedioic acid

Systemtic Name: 4-(4-bromanyl-2,6-dimethyl-phenoxy)-N-methyl-butan-1-amine; ethanedioic acid Openeye Name: 4-(4-bromo-2,6-dimethyl-phenoxy)-N-methyl-butan-1-amine; oxalic acid CAS Name: 4-(4-bromo-2,6-dimethylphenoxy)-N-methyl-1-butanamine; oxalic acid IUPAC Name: 4-(4-bromo-2,6-dimethylphenoxy)-N-methylbutan-1-amine; oxalic acid Traditional Name: 4-(4-bromo-2,6-dimethyl-phenoxy)butyl-methyl-amine; oxalic acid Formula: C15H22BrNO5 MolecularWeight: 376.24288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCCNC)C)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC(=C1OCCCCNC)C)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20BrNO.C2H2O4/c1-10-8-12(14)9-11(2)13(10)16-7-5-4-6-15-3;3-1(4)2(5)6/h8-9,15H,4-7H2,1-3H3;(H,3,4)(H,5,6)