methyl 2-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(2-indan-5-ylsulfanylacetyl)oxyacetyl]amino]benzoate CAS Name: 2-[[2-[2-(2,3-dihydro-1H-inden-5-ylthio)-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[2-(indan-5-ylthio)acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H21NO5S/c1-26-21(25)17-7-2-3-8-18(17)22-19(23)12-27-20(24)13-28-16-10-9-14-5-4-6-15(14)11-16/h2-3,7-11H,4-6,12-13H2,1H3,(H,22,23)