Basic information
- Standard SMILES
O=C(Nc1ccc(S(=O)(=O)O)c2ccccc12)c1ccccc1- InChIKey
DXXGXTODRFZWOB-UHFFFAOYSA-N- Molecular formula
- C17H13NO4S
- Average molar mass
- 327.4 g/mol
Names & identifiers
- Preferred name
- 4-Benzoylamino-naphthalene-1-sulfonic acid
- IUPAC
- 4-benzamidonaphthalene-1-sulfonic acid
Names & synonyms
SCHEMBL1338412CHEMBL3343504DXXGXTODRFZWOB-UHFFFAOYSA-N4-benzoylamino-napthalene-1-sulfonic acid4-benzoylamino-naphthalene-1-sulfonic acid
Database identifiers
- PubChem CID
- 3530106
- ChEMBL
CHEMBL3343504
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 521
Related reactions
8 records
Compound notes
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