2-methyl-4-(7-oxidanyl-7-oxidanylidene-heptyl)-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-methyl-4-(7-oxidanyl-7-oxidanylidene-heptyl)-1,3-thiazole-5-carboxylic acid Openeye Name: 4-(7-hydroxy-7-oxo-heptyl)-2-methyl-thiazole-5-carboxylic acid CAS Name: 4-(7-hydroxy-7-oxoheptyl)-2-methyl-5-thiazolecarboxylic acid IUPAC Name: 4-(7-hydroxy-7-oxoheptyl)-2-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 4-(7-hydroxy-7-keto-heptyl)-2-methyl-thiazole-5-carboxylic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)O)CCCCCCC(=O)O

Isomeric SMILES

CC1=NC(=C(S1)C(=O)O)CCCCCCC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-8-13-9(11(18-8)12(16)17)6-4-2-3-5-7-10(14)15/h2-7H2,1H3,(H,14,15)(H,16,17)