4-[4-(2-ethylhexoxy)-5-methyl-1,3-thiazol-2-yl]benzoic acid

Systemtic Name: 4-[4-(2-ethylhexoxy)-5-methyl-1,3-thiazol-2-yl]benzoic acid Openeye Name: 4-[4-(2-ethylhexoxy)-5-methyl-thiazol-2-yl]benzoic acid CAS Name: 4-[4-(2-ethylhexoxy)-5-methyl-2-thiazolyl]benzoic acid IUPAC Name: 4-[4-(2-ethylhexoxy)-5-methyl-1,3-thiazol-2-yl]benzoic acid Traditional Name: 4-[4-(2-ethylhexoxy)-5-methyl-thiazol-2-yl]benzoic acid Formula: C19H25NO3S MolecularWeight: 347.4717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(SC(=N1)C2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CCCCC(CC)COC1=C(SC(=N1)C2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C19H25NO3S/c1-4-6-7-14(5-2)12-23-17-13(3)24-18(20-17)15-8-10-16(11-9-15)19(21)22/h8-11,14H,4-7,12H2,1-3H3,(H,21,22)