Diethyl-[2-[(3-propoxyphenyl)carbamoyloxy]ethyl]azanium chloride

HCID 57005

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Basic information

CAS: 96024-51-0
Standard SMILES: CCCOc1cccc(NC(=O)OCC[NH+](CC)CC)c1.[Cl-]
InChIKey: XUGRCDLFQORRTE-UHFFFAOYSA-N
Molecular formula: C16H27ClN2O3
Average molar mass: 330.8 g/mol
Monoisotopic mass: 330.1710204

Names & identifiers

Preferred name: Diethyl-[2-[(3-propoxyphenyl)carbamoyloxy]ethyl]azanium chloride
IUPAC: diethyl-[2-[(3-propoxyphenyl)carbamoyloxy]ethyl]azanium chloride

Names & synonyms

diethyl-[2-[(3-propoxyphenyl)carbamoyloxy]ethyl]azanium chloride96024-51-0DTXSID70275622N,N-Diethyl-2-{[(3-propoxyphenyl)carbamoyl]oxy}ethan-1-aminium chloride

Database identifiers

CAS: 96024-51-0
PubChem CID: 57005
DTXSID: DTXSID70275622

Properties

Computed structural properties

Topological polar surface area: 52 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 10
Heavy atoms: 22
Formal charge: 0
Complexity: 283

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