VWO
Summary
Name: | 6-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid |
Synonyms: | 7-amino-1-naphthol-3-sulfonic acid |
Formula: | C10 H9 N O4 S |
Formal charge: | 0 |
Formula weight: | 239.248 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 6-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15) |
InChIKey | InChI | 1.06 | HBZVNWNSRNTWPS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc2cc(cc(O)c2c1)[S](O)(=O)=O |
SMILES | CACTVS | 3.385 | Nc1ccc2cc(cc(O)c2c1)[S](O)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc2c1cc(cc2O)S(=O)(=O)O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc2c1cc(cc2O)S(=O)(=O)O)N |