(2R)-2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbutanoate

Systemtic Name: (2R)-2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbutanoate Openeye Name: (2R)-2-[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanylbutanoate CAS Name: (2R)-2-[[2-(4-ethoxyanilino)-2-oxoethyl]thio]butanoate IUPAC Name: (2R)-2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanylbutanoate Traditional Name: (2R)-2-[[2-keto-2-(p-phenetidino)ethyl]thio]butyrate Formula: C14H18NO4S- MolecularWeight: 296.36202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])SCC(=O)NC1=CC=C(C=C1)OCC

Isomeric SMILES

CC[C@H](C(=O)[O-])SCC(=O)NC1=CC=C(C=C1)OCC

InChI

InChI=1S/C14H19NO4S/c1-3-12(14(17)18)20-9-13(16)15-10-5-7-11(8-6-10)19-4-2/h5-8,12H,3-4,9H2,1-2H3,(H,15,16)(H,17,18)/p-1/t12-/m1/s1