2-[4-(4-butyl-1,3-thiazol-2-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(4-butyl-1,3-thiazol-2-yl)phenyl]propanoic acid Openeye Name: 2-[4-(4-butylthiazol-2-yl)phenyl]propanoic acid CAS Name: 2-[4-(4-butyl-2-thiazolyl)phenyl]propanoic acid IUPAC Name: 2-[4-(4-butyl-1,3-thiazol-2-yl)phenyl]propanoic acid Traditional Name: 2-[4-(4-butylthiazol-2-yl)phenyl]propionic acid Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC(=N1)C2=CC=C(C=C2)C(C)C(=O)O

Isomeric SMILES

CCCCC1=CSC(=N1)C2=CC=C(C=C2)C(C)C(=O)O

InChI

InChI=1S/C16H19NO2S/c1-3-4-5-14-10-20-15(17-14)13-8-6-12(7-9-13)11(2)16(18)19/h6-11H,3-5H2,1-2H3,(H,18,19)