N-((4-(Acetylamino)phenyl)sulfonyl)glycine methyl ester

HCID 798963

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Basic information

CAS: 99842-20-3
Standard SMILES: COC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1
InChIKey: PDZHQONMMASSJG-UHFFFAOYSA-N
Molecular formula: C11H14N2O5S
Average molar mass: 286.31 g/mol
Monoisotopic mass: 286.06234272

Names & identifiers

Preferred name: N-((4-(Acetylamino)phenyl)sulfonyl)glycine methyl ester
IUPAC: methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate

Names & synonyms

99842-20-3N-[[4-(Acetylamino)phenyl]sulfonyl]glycine methyl esterN-((4-(Acetylamino)phenyl)sulfonyl)glycine methyl esterRefChem:359644Oprea1_617680Oprea1_834214DTXSID701205868AKOS003858629Methyl N-(4-acetamidobenzene-1-sulfonyl)glycinateSR-01000486158SR-01000486158-1

Database identifiers

CAS: 99842-20-3
PubChem CID: 798963
DTXSID: DTXSID701205868

Properties

Computed structural properties

XLogP: 0
Topological polar surface area: 110 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 19
Formal charge: 0
Complexity: 421

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