Compound C16H21ClN2O3

3-methyl-6-(3-piperidin-1-ium-1-ylpropanoyl)-1,3-benzoxazol-2-one chloride

CAS: 59384-75-7

Molecular Formula	`C16H21ClN2O3`
Molecular Weight	324.8 g/mol
Topological Polar Surface Area	51.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	324.12408
Heavy Atoms	22
Complexity	406.0

Chemical Identifiers

CAS Number	59384-75-7
SMILES	`CN1C2=C(C=C(C=C2)C(=O)CC[NH+]3CCCCC3)OC1=O.[Cl-]`
InChIKey	`LGYDYIOFKKOACU-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H21ClN2O3 (CAS: 59384-75-7) is a chemical compound with molecular formula C16H21ClN2O3 and molecular weight 324.8 g/mol. Its IUPAC systematic name is 3-methyl-6-(3-piperidin-1-ium-1-ylpropanoyl)-1,3-benzoxazol-2-one chloride. Topological Polar Surface Area 51.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 324.12408 Heavy Atoms 22 Complexity 406.0 InChI Key: LGYDYIOFKKOACU-UHFFFAOYSA-N. SMILES: CN1C2=C(C=C(C=C2)C(=O)CC[NH+]3CCCCC3)OC1=O.[Cl-].

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