9-chloranyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylazanium

Systemtic Name: 9-chloranyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylazanium Openeye Name: 9-chloro-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylammonium CAS Name: 9-chloro-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylammonium IUPAC Name: 9-chloro-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylazanium Traditional Name: 9-chloro-4-keto-5H-thiochromeno[4,3-b]pyran-2-carboxylate; 2-hydroxyethylammonium Formula: C15H14ClNO5S MolecularWeight: 355.79336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=C(S1)C=CC(=C3)Cl)OC(=CC2=O)C(=O)[O-].C(CO)[NH3+]

Isomeric SMILES

C1C2=C(C3=C(S1)C=CC(=C3)Cl)OC(=CC2=O)C(=O)[O-].C(CO)[NH3+]

InChI

InChI=1S/C13H7ClO4S.C2H7NO/c14-6-1-2-11-7(3-6)12-8(5-19-11)9(15)4-10(18-12)13(16)17;3-1-2-4/h1-4H,5H2,(H,16,17);4H,1-3H2