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2-[3-(3-bromanylphenoxy)propylamino]ethanol; ethanedioic acid

2-[3-(3-bromanylphenoxy)propylamino]ethanol; ethanedioic acid

Systemtic Name:2-[3-(3-bromanylphenoxy)propylamino]ethanol; ethanedioic acid
Openeye Name:2-[3-(3-bromophenoxy)propylamino]ethanol; oxalic acid
CAS Name:2-[3-(3-bromophenoxy)propylamino]ethanol; oxalic acid
IUPAC Name:2-[3-(3-bromophenoxy)propylamino]ethanol; oxalic acid
Traditional Name:2-[3-(3-bromophenoxy)propylamino]ethanol; oxalic acid
Formula: C13H18BrNO6
MolecularWeight: 364.18912
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCCCNCCO.C(=O)(C(=O)O)O


Isomeric SMILES

C1=CC(=CC(=C1)Br)OCCCNCCO.C(=O)(C(=O)O)O


InChI

InChI=1S/C11H16BrNO2.C2H2O4/c12-10-3-1-4-11(9-10)15-8-2-5-13-6-7-14;3-1(4)2(5)6/h1,3-4,9,13-14H,2,5-8H2;(H,3,4)(H,5,6)


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