N-[3-(3-bromanylphenoxy)propyl]butan-2-amine; ethanedioic acid

Systemtic Name: N-[3-(3-bromanylphenoxy)propyl]butan-2-amine; ethanedioic acid Openeye Name: N-[3-(3-bromophenoxy)propyl]butan-2-amine; oxalic acid CAS Name: N-[3-(3-bromophenoxy)propyl]-2-butanamine; oxalic acid IUPAC Name: N-[3-(3-bromophenoxy)propyl]butan-2-amine; oxalic acid Traditional Name: 3-(3-bromophenoxy)propyl-sec-butyl-amine; oxalic acid Formula: C15H22BrNO5 MolecularWeight: 376.24288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=CC(=CC=C1)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCCOC1=CC(=CC=C1)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20BrNO.C2H2O4/c1-3-11(2)15-8-5-9-16-13-7-4-6-12(14)10-13;3-1(4)2(5)6/h4,6-7,10-11,15H,3,5,8-9H2,1-2H3;(H,3,4)(H,5,6)