Tert-butyl {2-chloro-5-[(6-nitropyridin-3-yl)oxy]phenyl}carbamate

HCID 57749305
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Basic information

Standard SMILES
CC(C)(C)OC(=O)Nc1cc(Oc2ccc([N+](=O)[O-])nc2)ccc1Cl
InChIKey
DDMBPLLAKSPAFM-UHFFFAOYSA-N
Molecular formula
C16H16ClN3O5
Average molar mass
365.77 g/mol

Names & identifiers

Preferred name
Tert-butyl {2-chloro-5-[(6-nitropyridin-3-yl)oxy]phenyl}carbamate
IUPAC
tert-butyl N-[2-chloro-5-[(6-nitro-3-pyridinyl)oxy]phenyl]carbamate

Names & synonyms

SCHEMBL13636122DDMBPLLAKSPAFM-UHFFFAOYSA-Ntert-butyl {2-chloro-5-[(6-nitropyridin-3-yl)oxy]phenyl}carbamate

Database identifiers

PubChem CID
57749305

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
106 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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