(2S)-2-[2-[3-(2-ethoxyphenoxy)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-[3-(2-ethoxyphenoxy)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-[3-(2-ethoxyphenoxy)-4-oxo-chromen-7-yl]oxyacetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-[[3-(2-ethoxyphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-[3-(2-ethoxyphenoxy)-4-oxochromen-7-yl]oxyacetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-[3-(2-ethoxyphenoxy)-4-keto-chromen-7-yl]oxyacetyl]amino]-4-(methylthio)butyrate Formula: C24H24NO8S- MolecularWeight: 486.51426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C24H25NO8S/c1-3-30-18-6-4-5-7-19(18)33-21-13-32-20-12-15(8-9-16(20)23(21)27)31-14-22(26)25-17(24(28)29)10-11-34-2/h4-9,12-13,17H,3,10-11,14H2,1-2H3,(H,25,26)(H,28,29)/p-1/t17-/m0/s1