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Carbanilic acid, m-decyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride

HCID 50084
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Basic information

CAS
68097-72-3
Standard SMILES
CCCCCCCCCCOc1cccc(NC(=O)OCC[NH+](C)C)c1.[Cl-]
InChIKey
GHGWKIHLPHYCAP-UHFFFAOYSA-N
Molecular formula
C21H37ClN2O3
Average molar mass
401 g/mol
Monoisotopic mass
400.2492707

Names & identifiers

Preferred name
Carbanilic acid, m-decyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride
IUPAC
2-[(3-decoxyphenyl)carbamoyloxy]ethyl-dimethylazanium chloride

Names & synonyms

2-(Dimethylamino)ethyl m-decyloxycarbanilate hydrochloride68097-72-3m-Decyloxycarbanilic acid 2-(dimethylamino)ethyl ester hydrochlorideCARBANILIC ACID, m-DECYLOXY-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDERefChem:333040

Database identifiers

CAS
68097-72-3
PubChem CID
50084

Properties

Computed structural properties

Topological polar surface area
52 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
15
Heavy atoms
27
Formal charge
0
Complexity
350

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