Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-sec-butyl-N-ethylamino)ethyl) ester, hydrochloride

HCID 18002

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Basic information

CAS: 2912-90-5
Standard SMILES: CCOC(C(=O)OCC[NH+](CC)C(C)CC)(c1ccccc1)c1ccccc1.[Cl-]
InChIKey: NNOMLXCKOVWKLM-UHFFFAOYSA-N
Molecular formula: C24H34ClNO3
Average molar mass: 420 g/mol
Monoisotopic mass: 419.2227216

Names & identifiers

Preferred name: Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-sec-butyl-N-ethylamino)ethyl) ester, hydrochloride
IUPAC: butan-2-yl-[2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl]-ethylazanium chloride

Names & synonyms

Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-sec-butyl-N-ethylamino)ethyl) ester, hydrochloride2912-90-52,2-Diphenyl-2-ethoxyacetic acid (2-(N-sec-butyl-N-ethylamino)ethyl) ester hydrochlorideRefChem:3163882,2-Diphenyl-2-ethoxyacetic acid (2-(N-sec-butyl-N-ethylamino)ethyl) e ster hydrochloride

Database identifiers

CAS: 2912-90-5
PubChem CID: 18002

Properties

Computed structural properties

Topological polar surface area: 40 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 12
Heavy atoms: 29
Formal charge: 0
Complexity: 423

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