2-Benzoxazolinone, 3-methyl-6-(3-morpholinopropionyl)-, hydrochloride

HCID 43022

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Basic information

CAS: 59384-76-8
Standard SMILES: Cn1c(=O)oc2cc(C(=O)CC[NH+]3CCOCC3)ccc21.[Cl-]
InChIKey: WINZILUVXFYSOK-UHFFFAOYSA-N
Molecular formula: C15H19ClN2O4
Average molar mass: 326.77 g/mol
Monoisotopic mass: 326.1033348

Names & identifiers

Preferred name: 2-Benzoxazolinone, 3-methyl-6-(3-morpholinopropionyl)-, hydrochloride
IUPAC: 3-methyl-6-(3-morpholin-4-ium-4-ylpropanoyl)-1,3-benzoxazol-2-one chloride

Names & synonyms

3-Methyl-6-(3-morpholinopropionyl)-2-benzoxazolinone hydrochloride59384-76-82-BENZOXAZOLINONE, 3-METHYL-6-(3-MORPHOLINOPROPIONYL)-, HYDROCHLORIDERefChem:256424

Database identifiers

CAS: 59384-76-8
PubChem CID: 43022

Properties

Computed structural properties

Topological polar surface area: 60.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 22
Formal charge: 0
Complexity: 408

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