sodium 2-[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]propylsulfanyl]ethanoate

Systemtic Name: sodium 2-[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]propylsulfanyl]ethanoate Openeye Name: sodium 2-[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]propylsulfanyl]acetate CAS Name: sodium 2-[3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]propylthio]acetate IUPAC Name: sodium 2-[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]propylsulfanyl]acetate Traditional Name: sodium 2-[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]propylthio]acetate Formula: C17H20NNaO4S MolecularWeight: 357.39977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOCCCSCC(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOCCCSCC(=O)[O-].[Na+]

InChI

InChI=1S/C17H21NO4S.Na/c1-13-15(8-10-21-9-5-11-23-12-16(19)20)18-17(22-13)14-6-3-2-4-7-14;/h2-4,6-7H,5,8-12H2,1H3,(H,19,20);/q;+1/p-1