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3-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]azepan-2-one hydrochloride
3-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]azepan-2-one hydrochloride
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Descriptors Computed from Structure
Canonical SMILES:
C1CCNC(=O)C(C1)NCC2=CC3=C(C(=C2)Br)OCO3.Cl
Isomeric SMILES
C1CCNC(=O)C(C1)NCC2=CC3=C(C(=C2)Br)OCO3.Cl
InChI
InChI=1S/C14H17BrN2O3.ClH/c15-10-5-9(6-12-13(10)20-8-19-12)7-17-11-3-1-2-4-16-14(11)18;/h5-6,11,17H,1-4,7-8H2,(H,16,18);1H
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