2-(2-methylphenoxy)ethyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate

Systemtic Name: 2-(2-methylphenoxy)ethyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate Openeye Name: 2-(2-methylphenoxy)ethyl 2-[(5-methylisoxazol-3-yl)methylsulfanyl]benzoate CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]benzoic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]benzoic acid 2-(2-methylphenoxy)ethyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOC(=O)C2=CC=CC=C2SCC3=NOC(=C3)C

Isomeric SMILES

CC1=CC=CC=C1OCCOC(=O)C2=CC=CC=C2SCC3=NOC(=C3)C

InChI

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