2-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-1,3-thiazole-4-carboxylic acid Openeye Name: 2-(3-chloro-4-hexoxy-5-methoxy-phenyl)thiazole-4-carboxylic acid CAS Name: 2-(3-chloro-4-hexoxy-5-methoxyphenyl)-4-thiazolecarboxylic acid IUPAC Name: 2-(3-chloro-4-hexoxy-5-methoxyphenyl)-1,3-thiazole-4-carboxylic acid Traditional Name: 2-(3-chloro-4-hexoxy-5-methoxy-phenyl)thiazole-4-carboxylic acid Formula: C17H20ClNO4S MolecularWeight: 369.863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=CS2)C(=O)O)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=CS2)C(=O)O)OC

InChI

InChI=1S/C17H20ClNO4S/c1-3-4-5-6-7-23-15-12(18)8-11(9-14(15)22-2)16-19-13(10-24-16)17(20)21/h8-10H,3-7H2,1-2H3,(H,20,21)