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Diethyl 2-[[2-(4-aminophenyl)acetyl]amino]pentanedioate

HCID 281815
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
41934-84-3
Standard SMILES
CCOC(=O)CCC(NC(=O)Cc1ccc(N)cc1)C(=O)OCC
InChIKey
KZNZDJFLHCYTFC-UHFFFAOYSA-N
Molecular formula
C17H24N2O5
Average molar mass
336.4 g/mol
Monoisotopic mass
336.16852187

Names & identifiers

Preferred name
Diethyl 2-[[2-(4-aminophenyl)acetyl]amino]pentanedioate
IUPAC
diethyl 2-[[2-(4-aminophenyl)acetyl]amino]pentanedioate

Names & synonyms

diethyl 2-[[2-(4-aminophenyl)acetyl]amino]pentanedioate41934-84-3diethyl n-[(4-aminophenyl)acetyl]glutamateNSC134703DTXSID70300084NSC-134703DS-010783

Database identifiers

CAS
41934-84-3
PubChem CID
281815
DTXSID
DTXSID70300084

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
108 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
24
Formal charge
0
Complexity
419

Related reactions

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Compound notes

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