(2-acetamido-1,3-thiazol-4-yl)methyl 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-chloranyl-5-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 3-chloro-4-isobutoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-chloro-5-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-chloro-4-isobutoxy-5-methoxy-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C18H21ClN2O5S MolecularWeight: 412.88774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC2=CSC(=N2)NC(=O)C)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)OCC2=CSC(=N2)NC(=O)C)OC

InChI

InChI=1S/C18H21ClN2O5S/c1-10(2)7-25-16-14(19)5-12(6-15(16)24-4)17(23)26-8-13-9-27-18(21-13)20-11(3)22/h5-6,9-10H,7-8H2,1-4H3,(H,20,21,22)