2-[4-(5-butan-2-yl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(5-butan-2-yl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(2-benzyloxy-5-sec-butyl-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(5-butan-2-yl-2-phenylmethoxyphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(5-butan-2-yl-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(2-benzoxy-5-sec-butyl-phenyl)thiazol-2-yl]acetic acid Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC(=N3)CC(=O)O

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC(=N3)CC(=O)O

InChI

InChI=1S/C22H23NO3S/c1-3-15(2)17-9-10-20(26-13-16-7-5-4-6-8-16)18(11-17)19-14-27-21(23-19)12-22(24)25/h4-11,14-15H,3,12-13H2,1-2H3,(H,24,25)