Basic information
- Standard SMILES
CC(C)(C)OC(=O)CON=C(C(=O)O)c1nc(NC=O)sc1Cl- InChIKey
MJNRKEYQIVUDNZ-UHFFFAOYSA-N- Molecular formula
- C12H14ClN3O6S
- Average molar mass
- 363.77 g/mol
- Monoisotopic mass
- 363.029184
Names & identifiers
- Preferred name
- 2-(2-Formamido-5-chlorothiazol-4-yl)-2-tert-butoxycarbonylmethoxyiminoacetic acid
- IUPAC
- 2-(5-chloro-2-formamido-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetic acid
Names & synonyms
SCHEMBL9482619MJNRKEYQIVUDNZ-UHFFFAOYSA-N2-(2-formamido-5-chlorothiazol-4-yl)-2-tert-butoxycarbonylmethoxyiminoacetic acid2-(2-formamido-5-chlorothiazol-4-yl)-2-tertbutoxycarbonylmethoxyiminoacetic acid2-(5-Chloro-2-formamidothiazol-4-yl)-2-t-butoxycarbonylmethoxyiminoacetic acid2-(t-Butoxycarbonylmethoxyimino)-2-(2-formamido-5-chlorothiazol-4-yl)acetic acid2-tert-butoxycarbonylmethoxyimino-2-(2-formamido-5-chlorothiazol-4-yl) acetic acid2-tert-butoxycarbonylmethoxyimino-2-(2-formamido-5-chlorothiazol-4-yl)acetic acid2-tert-butoxycarbonylmethoxyimino-2-(2-formamido-5-chlorothiazol-4yl)acetic acid
Database identifiers
- PubChem CID
- 54075755
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 496
Related reactions
19 records
Compound notes
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