4-[(2-butan-2-ylphenoxy)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(2-butan-2-ylphenoxy)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(2-sec-butylphenoxy)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(2-butan-2-ylphenoxy)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(2-butan-2-ylphenoxy)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(2-sec-butylphenoxy)methyl]thiazole-2-carboxylic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC2=CSC(=N2)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C15H17NO3S/c1-3-10(2)12-6-4-5-7-13(12)19-8-11-9-20-14(16-11)15(17)18/h4-7,9-10H,3,8H2,1-2H3,(H,17,18)