2-[4-[(Z)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-bromanyl-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-bromanyl-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-(2-acetamido-4-oxo-thiazol-5-ylidene)methyl]-2-bromo-6-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(Z)-(2-acetamido-4-oxo-5-thiazolylidene)methyl]-2-bromo-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-(2-acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-bromo-6-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(Z)-(2-acetamido-4-keto-2-thiazolin-5-ylidene)methyl]-2-bromo-6-methoxy-phenoxy]acetic acid Formula: C15H13BrN2O6S MolecularWeight: 429.24252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC(=O)O)OC)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OCC(=O)O)OC)/S1

InChI

InChI=1S/C15H13BrN2O6S/c1-7(19)17-15-18-14(22)11(25-15)5-8-3-9(16)13(10(4-8)23-2)24-6-12(20)21/h3-5H,6H2,1-2H3,(H,20,21)(H,17,18,19,22)/b11-5-