3-(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenoxy)-2-methoxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenoxy)-2-methoxy-3-oxidanylidene-propanoic acid Openeye Name: 3-(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenoxy)-2-methoxy-3-oxo-propanoic acid CAS Name: 3-[3-(2-imidazo[2,1-b][1,3]benzothiazolyl)phenoxy]-2-methoxy-3-oxopropanoic acid IUPAC Name: 3-(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenoxy)-2-methoxy-3-oxopropanoic acid Traditional Name: 3-(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenoxy)-3-keto-2-methoxy-propionic acid Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)O)C(=O)OC1=CC=CC(=C1)C2=CN3C4=CC=CC=C4SC3=N2

Isomeric SMILES

COC(C(=O)O)C(=O)OC1=CC=CC(=C1)C2=CN3C4=CC=CC=C4SC3=N2

InChI

InChI=1S/C19H14N2O5S/c1-25-16(17(22)23)18(24)26-12-6-4-5-11(9-12)13-10-21-14-7-2-3-8-15(14)27-19(21)20-13/h2-10,16H,1H3,(H,22,23)