Basic information
- Standard SMILES
CC1=C(C(=O)O)N2C(=O)C(NC(=O)c3ccccc3)[C@H]2S(=O)C1- InChIKey
HRZNDPUIXBTALJ-GGKQNVFXSA-N- Molecular formula
- C15H14N2O5S
- Average molar mass
- 334.3 g/mol
Names & identifiers
- Preferred name
- 7-Benzamido-3-methyl-3-cephem-4-carboxylic acid-1-oxide
- IUPAC
- (6R)-7-benzamido-3-methyl-5,8-dioxo-5λ4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Names & synonyms
SCHEMBL10881770HRZNDPUIXBTALJ-GGKQNVFXSA-N7-benzamido-3-methyl-3-cephem-4-carboxylic acid-1-oxide
Database identifiers
- PubChem CID
- 70464702
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 623
Related reactions
9 records
Compound notes
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