9-methyl-4-oxidanylidene-3-sulfanyl-pyrano[3,2-c]quinoline-2-carboxylic acid

Systemtic Name: 9-methyl-4-oxidanylidene-3-sulfanyl-pyrano[3,2-c]quinoline-2-carboxylic acid Openeye Name: 9-methyl-4-oxo-3-sulfanyl-pyrano[3,2-c]quinoline-2-carboxylic acid CAS Name: 3-mercapto-9-methyl-4-oxo-2-pyrano[3,2-c]quinolinecarboxylic acid IUPAC Name: 9-methyl-4-oxo-3-sulfanylpyrano[3,2-c]quinoline-2-carboxylic acid Traditional Name: 4-keto-3-mercapto-9-methyl-pyrano[3,2-c]quinoline-2-carboxylic acid Formula: C14H9NO4S MolecularWeight: 287.29056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C3C(=CN=C2C=C1)C(=O)C(=C(O3)C(=O)O)S

Isomeric SMILES

CC1=CC2=C3C(=CN=C2C=C1)C(=O)C(=C(O3)C(=O)O)S

InChI

InChI=1S/C14H9NO4S/c1-6-2-3-9-7(4-6)11-8(5-15-9)10(16)13(20)12(19-11)14(17)18/h2-5,20H,1H3,(H,17,18)