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

Systemtic Name: 2-(5-chloranyl-2-hexoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(5-chloro-2-hexoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-(5-chloro-2-hexoxyphenyl)-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-(5-chloro-2-hexoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(5-chloro-2-hexoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid Formula: C18H22ClNO3S MolecularWeight: 367.89018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Cl)C2=NC(=C(S2)C(=O)O)CC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Cl)C2=NC(=C(S2)C(=O)O)CC

InChI

InChI=1S/C18H22ClNO3S/c1-3-5-6-7-10-23-15-9-8-12(19)11-13(15)17-20-14(4-2)16(24-17)18(21)22/h8-9,11H,3-7,10H2,1-2H3,(H,21,22)