(2Z)-2-(3-hexyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: (2Z)-2-(3-hexyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid Openeye Name: (2Z)-2-(3-hexyl-4-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)thiazolidine-4-carboxylic acid CAS Name: (2Z)-2-(3-hexyl-4-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-thiazolidinecarboxylic acid IUPAC Name: (2Z)-2-(3-hexyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid Traditional Name: (2Z)-2-(3-hexyl-4-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)thiazolidine-4-carboxylic acid Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C2NC(CS2)C(=O)O)C(=O)C=C1O

Isomeric SMILES

CCCCCCC1=C/C(=C/2\NC(CS2)C(=O)O)/C(=O)C=C1O

InChI

InChI=1S/C16H21NO4S/c1-2-3-4-5-6-10-7-11(14(19)8-13(10)18)15-17-12(9-22-15)16(20)21/h7-8,12,17-18H,2-6,9H2,1H3,(H,20,21)/b15-11-