2-[3-[2-(4-propan-2-ylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[3-[2-(4-propan-2-ylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[3-[2-(4-isopropylphenoxy)ethoxy]phenyl]thiazole-4-carboxylic acid CAS Name: 2-[3-[2-(4-propan-2-ylphenoxy)ethoxy]phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[3-[2-(4-propan-2-ylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[3-[2-(4-isopropylphenoxy)ethoxy]phenyl]thiazole-4-carboxylic acid Formula: C21H21NO4S MolecularWeight: 383.46074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C3=NC(=CS3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C3=NC(=CS3)C(=O)O

InChI

InChI=1S/C21H21NO4S/c1-14(2)15-6-8-17(9-7-15)25-10-11-26-18-5-3-4-16(12-18)20-22-19(13-27-20)21(23)24/h3-9,12-14H,10-11H2,1-2H3,(H,23,24)