Imino-[5-[2-(2-methoxyethoxy)ethoxysulfonyl]-1-oxonaphthalen-2-ylidene]azanium
Basic information
- CAS
71550-36-2- Standard SMILES
COCCOCCOS(=O)(=O)c1cccc2c1C=CC(=[N+]=N)C2=O- InChIKey
WPKFZOAGILKDHC-UHFFFAOYSA-N- Molecular formula
- C15H17N2O6S+
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.08073244
Names & identifiers
- Preferred name
- Imino-[5-[2-(2-methoxyethoxy)ethoxysulfonyl]-1-oxonaphthalen-2-ylidene]azanium
- IUPAC
- imino-[5-[2-(2-methoxyethoxy)ethoxysulfonyl]-1-oxonaphthalen-2-ylidene]azanium
Names & synonyms
SCHEMBL21820167
Database identifiers
- CAS
71550-36-2- PubChem CID
- 6367248
Properties
Computed structural properties
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 1
- Complexity
- 633
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Compound notes
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