6,7-diacetyloxy-4-oxidanylidene-thiochromene-3-carboxylic acid

Systemtic Name: 6,7-diacetyloxy-4-oxidanylidene-thiochromene-3-carboxylic acid Openeye Name: 6,7-diacetoxy-4-oxo-thiochromene-3-carboxylic acid CAS Name: 6,7-diacetyloxy-4-oxo-1-benzothiopyran-3-carboxylic acid IUPAC Name: 6,7-diacetyloxy-4-oxothiochromene-3-carboxylic acid Traditional Name: 6,7-diacetoxy-4-keto-thiochromene-3-carboxylic acid Formula: C14H10O7S MolecularWeight: 322.29

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1)C(=O)C(=CS2)C(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1)C(=O)C(=CS2)C(=O)O)OC(=O)C

InChI

InChI=1S/C14H10O7S/c1-6(15)20-10-3-8-12(4-11(10)21-7(2)16)22-5-9(13(8)17)14(18)19/h3-5H,1-2H3,(H,18,19)