2-hydroxyethylazanium; 9-methyl-4-oxidanylidene-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate

Systemtic Name: 2-hydroxyethylazanium; 9-methyl-4-oxidanylidene-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate Openeye Name: 2-hydroxyethylammonium; 9-methyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate CAS Name: 2-hydroxyethylammonium; 9-methyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate IUPAC Name: 2-hydroxyethylazanium; 9-methyl-4-oxo-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate Traditional Name: 2-hydroxyethylammonium; 4-keto-9-methyl-1,5-dihydrothiochromeno[4,3-b]pyridine-2-carboxylate Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=C2NC(=CC3=O)C(=O)[O-].C(CO)[NH3+]

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=C2NC(=CC3=O)C(=O)[O-].C(CO)[NH3+]

InChI

InChI=1S/C14H11NO3S.C2H7NO/c1-7-2-3-12-8(4-7)13-9(6-19-12)11(16)5-10(15-13)14(17)18;3-1-2-4/h2-5H,6H2,1H3,(H,15,16)(H,17,18);4H,1-3H2