(2-phenyl-1,3-thiazol-4-yl)methyl 4-(4-chloranyl-2-methyl-phenoxy)butanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-(4-chloranyl-2-methyl-phenoxy)butanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-(4-chloro-2-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-2-methylphenoxy)butanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-(4-chloro-2-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-2-methyl-phenoxy)butyric acid (2-phenylthiazol-4-yl)methyl ester Formula: C21H20ClNO3S MolecularWeight: 401.9064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H20ClNO3S/c1-15-12-17(22)9-10-19(15)25-11-5-8-20(24)26-13-18-14-27-21(23-18)16-6-3-2-4-7-16/h2-4,6-7,9-10,12,14H,5,8,11,13H2,1H3