3,4-bis(chloranyl)-2-octyl-3H-1,2-thiazole-5-carboxylic acid

Systemtic Name: 3,4-bis(chloranyl)-2-octyl-3H-1,2-thiazole-5-carboxylic acid Openeye Name: 3,4-dichloro-2-octyl-3H-isothiazole-5-carboxylic acid CAS Name: 3,4-dichloro-2-octyl-3H-isothiazole-5-carboxylic acid IUPAC Name: 3,4-dichloro-2-octyl-3H-1,2-thiazole-5-carboxylic acid Traditional Name: 3,4-dichloro-2-octyl-4-isothiazoline-5-carboxylic acid Formula: C12H19Cl2NO2S MolecularWeight: 312.25576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(C(=C(S1)C(=O)O)Cl)Cl

Isomeric SMILES

CCCCCCCCN1C(C(=C(S1)C(=O)O)Cl)Cl

InChI

InChI=1S/C12H19Cl2NO2S/c1-2-3-4-5-6-7-8-15-11(14)9(13)10(18-15)12(16)17/h11H,2-8H2,1H3,(H,16,17)