2-[2-(1-oxidanylcyclohexyl)ethyl]-4-oxidanylidene-6-propyl-5-(1,3-thiazolidin-2-yl)cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 2-[2-(1-oxidanylcyclohexyl)ethyl]-4-oxidanylidene-6-propyl-5-(1,3-thiazolidin-2-yl)cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 2-[2-(1-hydroxycyclohexyl)ethyl]-4-oxo-6-propyl-5-thiazolidin-2-yl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 2-[2-(1-hydroxycyclohexyl)ethyl]-4-oxo-6-propyl-5-(2-thiazolidinyl)-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 2-[2-(1-hydroxycyclohexyl)ethyl]-4-oxo-6-propyl-5-(1,3-thiazolidin-2-yl)cyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 2-[2-(1-hydroxycyclohexyl)ethyl]-4-keto-6-propyl-5-thiazolidin-2-yl-cyclohexa-1,5-diene-1-carboxylic acid Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)CC(=C1C(=O)O)CCC2(CCCCC2)O)C3NCCS3

Isomeric SMILES

CCCC1=C(C(=O)CC(=C1C(=O)O)CCC2(CCCCC2)O)C3NCCS3

InChI

InChI=1S/C21H31NO4S/c1-2-6-15-17(20(24)25)14(7-10-21(26)8-4-3-5-9-21)13-16(23)18(15)19-22-11-12-27-19/h19,22,26H,2-13H2,1H3,(H,24,25)