Basic information
- Standard SMILES
O=CNc1nc(C(=NOCC(=O)OCc2ccc([N+](=O)[O-])cc2)C(=O)O)cs1- InChIKey
YZIIVZZZWSCWHH-UHFFFAOYSA-N- Molecular formula
- C15H12N4O8S
- Average molar mass
- 408.3 g/mol
Names & identifiers
- Preferred name
- 2-(p-Nitrobenzyloxycarbonylmethoxyimino)-2-(2-formamidothiazol-4-yl)acetic acid
- IUPAC
- 2-(2-formamido-1,3-thiazol-4-yl)-2-[2-[(4-nitrophenyl)methoxy]-2-oxoethoxy]iminoacetic acid
Names & synonyms
SCHEMBL9482638YZIIVZZZWSCWHH-UHFFFAOYSA-N2-(p-Nitrobenzyloxycarbonylmethoxyimino)-2-(2-formamidothiazol-4-yl)acetic acid
Database identifiers
- PubChem CID
- 54535272
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 201 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 618
Related reactions
5 records
Compound notes
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