Propan-2-yl 2-[3-(ethylsulfamoyl)benzoyloxy]acetate

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Basic information

CAS: 1050659-60-3
Standard SMILES: CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)OC(C)C)c1
InChIKey: NXIDJYJRNNJCEB-UHFFFAOYSA-N
Molecular formula: C14H19NO6S
Average molar mass: 329.37 g/mol
Monoisotopic mass: 329.0933085

Names & identifiers

Preferred name: Propan-2-yl 2-[3-(ethylsulfamoyl)benzoyloxy]acetate
IUPAC: (2-oxo-2-propan-2-yloxyethyl) 3-(ethylsulfamoyl)benzoate

Names & synonyms

1050659-60-3propan-2-yl 2-[3-(ethylsulfamoyl)benzoyloxy]acetate(2-oxo-2-propan-2-yloxyethyl) 3-(ethylsulfamoyl)benzoateDTXSID401177456AKOS033767612Z2125698682-Oxo-2-[(propan-2-yl)oxy]ethyl 3-(ethylsulfamoyl)benzoate2-(1-Methylethoxy)-2-oxoethyl 3-[(ethylamino)sulfonyl]benzoate

Database identifiers

CAS: 1050659-60-3
PubChem CID: 30764201
DTXSID: DTXSID401177456

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 107 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 9
Heavy atoms: 22
Formal charge: 0
Complexity: 482

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Compound notes

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