2-[2-[4-(2-tert-butylphenoxy)phenyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[4-(2-tert-butylphenoxy)phenyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[4-(2-tert-butylphenoxy)phenyl]thiazol-4-yl]acetate CAS Name: 2-[2-[4-(2-tert-butylphenoxy)phenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[4-(2-tert-butylphenoxy)phenyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[4-(2-tert-butylphenoxy)phenyl]thiazol-4-yl]acetate Formula: C21H20NO3S- MolecularWeight: 366.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OC2=CC=C(C=C2)C3=NC(=CS3)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC2=CC=C(C=C2)C3=NC(=CS3)CC(=O)[O-]

InChI

InChI=1S/C21H21NO3S/c1-21(2,3)17-6-4-5-7-18(17)25-16-10-8-14(9-11-16)20-22-15(13-26-20)12-19(23)24/h4-11,13H,12H2,1-3H3,(H,23,24)/p-1