Basic information
- CAS
62077-09-2- Standard SMILES
Cc1cc2c(=O)c(=[N+]([O-])[O-])c(=O)c2cc1C.O.[Na+]- InChIKey
CCVFYFVABDKJST-UHFFFAOYSA-N- Molecular formula
- C11H10NNaO5
- Average molar mass
- 259.19 g/mol
- Monoisotopic mass
- 259.0456667
Overview
See also: Nivimedone (has active moiety).
Names & identifiers
- Preferred name
- Nivimedone Sodium
- IUPAC
- sodium;(5,6-dimethyl-1,3-dioxoinden-2-ylidene)-dioxidoazanium;hydrate
Names & synonyms
NIVIMEDONE SODIUM5,6-Dimethyl-2-aci-nitro-1,3-indandione sodium salt, monohydrate4953C873N262077-09-21H-Indene-1,3(2H)-dione, 5,6-dimethyl-2-nitro-, ion(1-), sodium, monohydrateRefChem:927831BRL 108335,6-dimethyl-2-nitroindane-1,3-dione, sodium saltnivimedone sodium hydrateNivimedone sodium [USAN]Q27259228
Database identifiers
- CAS
62077-09-2- PubChem CID
- 43916
- UNII
- 4953C873N2
Properties
Computed structural properties
- Topological polar surface area
- 81 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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