1-[3-(3-bromanylphenoxy)propyl]azepane; ethanedioic acid

Systemtic Name: 1-[3-(3-bromanylphenoxy)propyl]azepane; ethanedioic acid Openeye Name: 1-[3-(3-bromophenoxy)propyl]azepane; oxalic acid CAS Name: 1-[3-(3-bromophenoxy)propyl]azepane; oxalic acid IUPAC Name: 1-[3-(3-bromophenoxy)propyl]azepane; oxalic acid Traditional Name: 1-[3-(3-bromophenoxy)propyl]azepane; oxalic acid Formula: C17H24BrNO5 MolecularWeight: 402.28016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)CCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22BrNO.C2H2O4/c16-14-7-5-8-15(13-14)18-12-6-11-17-9-3-1-2-4-10-17;3-1(4)2(5)6/h5,7-8,13H,1-4,6,9-12H2;(H,3,4)(H,5,6)