(5R,7S)-7-methyl-8-oxidanylidene-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid

Systemtic Name: (5R,7S)-7-methyl-8-oxidanylidene-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid Openeye Name: (5R,7S)-7-methyl-8-oxo-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid CAS Name: (5R,7S)-7-methyl-8-oxo-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid IUPAC Name: (5R,7S)-7-methyl-8-oxo-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid Traditional Name: (5R,7S)-8-keto-7-methyl-5H-thiopyrano[4,3-f][1,3]benzodioxole-5-carboxylic acid Formula: C12H10O5S MolecularWeight: 266.2698

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C2=CC3=C(C=C2C(S1)C(=O)O)OCO3

Isomeric SMILES

C[C@H]1C(=O)C2=CC3=C(C=C2[C@@H](S1)C(=O)O)OCO3

InChI

InChI=1S/C12H10O5S/c1-5-10(13)6-2-8-9(17-4-16-8)3-7(6)11(18-5)12(14)15/h2-3,5,11H,4H2,1H3,(H,14,15)/t5-,11+/m0/s1