diethyl-[2-oxidanylidene-2-[(4-phenylsulfanylphenyl)amino]ethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: diethyl-[2-oxidanylidene-2-[(4-phenylsulfanylphenyl)amino]ethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: diethyl-[2-oxo-2-(4-phenylsulfanylanilino)ethyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: diethyl-[2-oxo-2-[4-(phenylthio)anilino]ethyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: diethyl-[2-oxo-2-(4-phenylsulfanylanilino)ethyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: diethyl-[2-keto-2-[4-(phenylthio)anilino]ethyl]ammonium binoxalate Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(=O)NC1=CC=C(C=C1)SC2=CC=CC=C2.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CC)CC(=O)NC1=CC=C(C=C1)SC2=CC=CC=C2.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H22N2OS.C2H2O4/c1-3-20(4-2)14-18(21)19-15-10-12-17(13-11-15)22-16-8-6-5-7-9-16;3-1(4)2(5)6/h5-13H,3-4,14H2,1-2H3,(H,19,21);(H,3,4)(H,5,6)