8-(4-Nitro-2-sulfobenzamido)-1,3,6-naphthalenetrisulfonic acid tetrasodium salt
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Basic information
- Standard SMILES
O=C(Nc1cc(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c12)c1ccc([N+](=O)[O-])cc1S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+]- InChIKey
XEJQXYNULJHEGR-UHFFFAOYSA-K- Molecular formula
- C17H9N2Na4O15S4+
- Average molar mass
- 701.5 g/mol
Names & identifiers
- Preferred name
- 8-(4-Nitro-2-sulfobenzamido)-1,3,6-naphthalenetrisulfonic acid tetrasodium salt
- IUPAC
- tetrasodium;8-[(4-nitro-2-sulfobenzoyl)amino]naphthalene-1,3,6-trisulfonate
Names & synonyms
XEJQXYNULJHEGR-UHFFFAOYSA-K8-(4-nitro-2-sulfobenzamido)-1,3,6-naphthalenetrisulfonic acid tetrasodium salt
Database identifiers
- PubChem CID
- 131711368
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 334 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 3
- Heavy atoms
- 42
- Formal charge
- 1
- Complexity
- 1,320
Related reactions
4 records
Compound notes
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