Basic information
- Standard SMILES
Nc1nc(C(=NOC2C=CCCC2)C(=O)O)cs1- InChIKey
RXSDJTDCCNTKTQ-UHFFFAOYSA-N- Molecular formula
- C11H13N3O3S
- Average molar mass
- 267.31 g/mol
- Monoisotopic mass
- 267.06776246
Names & identifiers
- Preferred name
- 2-(2-Cyclohexen-1-yl)oxyimino-2-(2-aminothiazol-4-yl)acetic acid
- IUPAC
- 2-(2-amino-1,3-thiazol-4-yl)-2-cyclohex-2-en-1-yloxyiminoacetic acid
Names & synonyms
SCHEMBL10925651RXSDJTDCCNTKTQ-UHFFFAOYSA-N2-(2-cyclohexen-1-yl)oxyimino-2-(2-aminothiazol-4-yl)acetic acid
Database identifiers
- PubChem CID
- 54291324
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 373
Related reactions
4 records
Compound notes
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