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4-{[(Azepan-1-yl)(1,2-benzoxazol-3-yl)acetyl]oxy}-1-ethyl-1-methylpiperidin-1-ium iodide

HCID 72012
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Basic information

CAS
86434-57-3
Standard SMILES
CC[N+]1(C)CCC(OC(=O)C(c2noc3ccccc23)N2CCCCCC2)CC1.[I-]
InChIKey
XEHKKWZHSSPBNZ-UHFFFAOYSA-M
Molecular formula
C23H34IN3O3
Average molar mass
527.447 g/mol
Monoisotopic mass
527.16448995

Names & identifiers

Preferred name
4-{[(Azepan-1-yl)(1,2-benzoxazol-3-yl)acetyl]oxy}-1-ethyl-1-methylpiperidin-1-ium iodide
IUPAC
4-{[(Azepan-1-yl)(1,2-benzoxazol-3-yl)acetyl]oxy}-1-ethyl-1-methylpiperidin-1-ium iodide

Database identifiers

CAS
86434-57-3
PubChem CID
72012
DTXSID
DTXSID001006843
ChEMBL
CHEMBL2104138

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