2-[2-(4-hexoxyphenyl)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(4-hexoxyphenyl)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(4-hexoxyphenyl)thiazol-4-yl]acetic acid CAS Name: 2-[2-(4-hexoxyphenyl)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(4-hexoxyphenyl)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(4-hexoxyphenyl)thiazol-4-yl]acetic acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C17H21NO3S/c1-2-3-4-5-10-21-15-8-6-13(7-9-15)17-18-14(12-22-17)11-16(19)20/h6-9,12H,2-5,10-11H2,1H3,(H,19,20)