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

Systemtic Name: sodium 2-[2-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]-1,3-thiazol-4-yl]propanoate Openeye Name: sodium 2-[2-[(2-benzyloxy-5-chloro-phenyl)methyl]thiazol-4-yl]propanoate CAS Name: sodium 2-[2-[(5-chloro-2-phenylmethoxyphenyl)methyl]-4-thiazolyl]propanoate IUPAC Name: sodium 2-[2-[(5-chloro-2-phenylmethoxyphenyl)methyl]-1,3-thiazol-4-yl]propanoate Traditional Name: sodium 2-[2-(2-benzoxy-5-chloro-benzyl)thiazol-4-yl]propionate Formula: C20H17ClNNaO3S MolecularWeight: 409.86165

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CSC(=N1)CC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C1=CSC(=N1)CC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H18ClNO3S.Na/c1-13(20(23)24)17-12-26-19(22-17)10-15-9-16(21)7-8-18(15)25-11-14-5-3-2-4-6-14;/h2-9,12-13H,10-11H2,1H3,(H,23,24);/q;+1/p-1