Basic information
- Standard SMILES
O=C(Nc1ccc2cc(S(=O)(=O)O)ccc2c1)OCc1ccccc1- InChIKey
URNCEBDXFPRJCI-UHFFFAOYSA-N- Molecular formula
- C18H15NO5S
- Average molar mass
- 357.4 g/mol
Names & identifiers
- Preferred name
- 6-{[(Benzyloxy)carbonyl]amino}naphthalene-2-sulfonic acid
- IUPAC
- 6-(phenylmethoxycarbonylamino)naphthalene-2-sulfonic acid
Names & synonyms
6-{[(benzyloxy)carbonyl]amino}naphthalene-2-sulfonic acid773035-04-4SCHEMBL2328795URNCEBDXFPRJCI-UHFFFAOYSA-NN-CBz-6-aminonaphthalene-2-sulfonic acidEN300-28299404
Database identifiers
- PubChem CID
- 21845872
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 552
Related reactions
2 records
Compound notes
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