diethyl-[2-[2-oxidanylidene-2-[(4-oxidanylidene-2-phenyl-chromen-3-yl)amino]ethyl]sulfanylethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: diethyl-[2-[2-oxidanylidene-2-[(4-oxidanylidene-2-phenyl-chromen-3-yl)amino]ethyl]sulfanylethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: diethyl-[2-[2-oxo-2-[(4-oxo-2-phenyl-chromen-3-yl)amino]ethyl]sulfanylethyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: diethyl-[2-[[2-oxo-2-[(4-oxo-2-phenyl-1-benzopyran-3-yl)amino]ethyl]thio]ethyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: diethyl-[2-[2-oxo-2-[(4-oxo-2-phenylchromen-3-yl)amino]ethyl]sulfanylethyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: diethyl-[2-[[2-keto-2-[(4-keto-2-phenyl-chromen-3-yl)amino]ethyl]thio]ethyl]ammonium binoxalate Formula: C25H28N2O7S MolecularWeight: 500.56402

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSCC(=O)NC1=C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CC)CCSCC(=O)NC1=C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C23H26N2O3S.C2H2O4/c1-3-25(4-2)14-15-29-16-20(26)24-21-22(27)18-12-8-9-13-19(18)28-23(21)17-10-6-5-7-11-17;3-1(4)2(5)6/h5-13H,3-4,14-16H2,1-2H3,(H,24,26);(H,3,4)(H,5,6)