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

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-bromanyl-5-methoxy-benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C14H13BrN2O4S MolecularWeight: 385.23302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=CC(=C2)OC)Br

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=CC(=C2)OC)Br

InChI

InChI=1S/C14H13BrN2O4S/c1-8(18)16-14-17-9(7-22-14)6-21-13(19)11-5-10(20-2)3-4-12(11)15/h3-5,7H,6H2,1-2H3,(H,16,17,18)