N-[2-(2-bromanyl-4-methyl-phenoxy)ethyl]butan-1-amine; ethanedioic acid

Systemtic Name: N-[2-(2-bromanyl-4-methyl-phenoxy)ethyl]butan-1-amine; ethanedioic acid Openeye Name: N-[2-(2-bromo-4-methyl-phenoxy)ethyl]butan-1-amine; oxalic acid CAS Name: N-[2-(2-bromo-4-methylphenoxy)ethyl]-1-butanamine; oxalic acid IUPAC Name: N-[2-(2-bromo-4-methylphenoxy)ethyl]butan-1-amine; oxalic acid Traditional Name: 2-(2-bromo-4-methyl-phenoxy)ethyl-butyl-amine; oxalic acid Formula: C15H22BrNO5 MolecularWeight: 376.24288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCOC1=C(C=C(C=C1)C)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCOC1=C(C=C(C=C1)C)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20BrNO.C2H2O4/c1-3-4-7-15-8-9-16-13-6-5-11(2)10-12(13)14;3-1(4)2(5)6/h5-6,10,15H,3-4,7-9H2,1-2H3;(H,3,4)(H,5,6)