sodium 2-[2-(5-bromanyl-2-phenylmethoxy-phenyl)-1,3-thiazol-4-yl]propanoate

Systemtic Name: sodium 2-[2-(5-bromanyl-2-phenylmethoxy-phenyl)-1,3-thiazol-4-yl]propanoate Openeye Name: sodium 2-[2-(2-benzyloxy-5-bromo-phenyl)thiazol-4-yl]propanoate CAS Name: sodium 2-[2-(5-bromo-2-phenylmethoxyphenyl)-4-thiazolyl]propanoate IUPAC Name: sodium 2-[2-(5-bromo-2-phenylmethoxyphenyl)-1,3-thiazol-4-yl]propanoate Traditional Name: sodium 2-[2-(2-benzoxy-5-bromo-phenyl)thiazol-4-yl]propionate Formula: C19H15BrNNaO3S MolecularWeight: 440.28607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CSC(=N1)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C1=CSC(=N1)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H16BrNO3S.Na/c1-12(19(22)23)16-11-25-18(21-16)15-9-14(20)7-8-17(15)24-10-13-5-3-2-4-6-13;/h2-9,11-12H,10H2,1H3,(H,22,23);/q;+1/p-1