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

Systemtic Name: 2-(3-chloranyl-5-ethoxy-4-hexoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-chloro-5-ethoxy-4-hexoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(3-chloro-5-ethoxy-4-hexoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-chloro-5-ethoxy-4-hexoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-chloro-5-ethoxy-4-hexoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C19H24ClNO4S MolecularWeight: 397.91616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=C(S2)C(=O)O)C)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=C(S2)C(=O)O)C)OCC

InChI

InChI=1S/C19H24ClNO4S/c1-4-6-7-8-9-25-16-14(20)10-13(11-15(16)24-5-2)18-21-12(3)17(26-18)19(22)23/h10-11H,4-9H2,1-3H3,(H,22,23)