3-methanethioyl-2-oxidanyl-4-oxidanylidene-pentane-1,2,3-tricarboxylic acid

Systemtic Name: 3-methanethioyl-2-oxidanyl-4-oxidanylidene-pentane-1,2,3-tricarboxylic acid Openeye Name: 2-hydroxy-3-methanethioyl-4-oxo-pentane-1,2,3-tricarboxylic acid CAS Name: 2-hydroxy-3-methanethioyl-4-oxopentane-1,2,3-tricarboxylic acid IUPAC Name: 2-hydroxy-3-methanethioyl-4-oxopentane-1,2,3-tricarboxylic acid Traditional Name: 2-hydroxy-4-keto-3-thioformyl-pentane-1,2,3-tricarboxylic acid Formula: C9H10O8S MolecularWeight: 278.2359

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C=S)(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(=O)C(C=S)(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C9H10O8S/c1-4(10)8(3-18,6(13)14)9(17,7(15)16)2-5(11)12/h3,17H,2H2,1H3,(H,11,12)(H,13,14)(H,15,16)