(4-tert-Butoxycarbonylamino-2-nitro-phenylamino)-acetic acid tert-butyl ester

HCID 67201113
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Basic information

Standard SMILES
CC(C)(C)OC(=O)CNc1ccc(NC(=O)OC(C)(C)C)cc1[N+](=O)[O-]
InChIKey
BHPRESFCUGIHRZ-UHFFFAOYSA-N
Molecular formula
C17H25N3O6
Average molar mass
367.4 g/mol

Names & identifiers

Preferred name
(4-tert-Butoxycarbonylamino-2-nitro-phenylamino)-acetic acid tert-butyl ester
IUPAC
tert-butyl 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitroanilino]acetate

Names & synonyms

SCHEMBL1888212BHPRESFCUGIHRZ-UHFFFAOYSA-N(4-tert-Butoxycarbonylamino-2-nitro-phenylamino)-acetic acid tert-butyl ester

Database identifiers

PubChem CID
67201113

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
122 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
26

Related reactions

6 records
New reaction record

Compound notes

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