methyl 3-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(2-indan-5-ylsulfanylacetyl)oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2-(2,3-dihydro-1H-inden-5-ylthio)-1-oxoethoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[2-(indan-5-ylthio)acetyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C22H23NO5S/c1-14-6-7-17(22(26)27-2)11-19(14)23-20(24)12-28-21(25)13-29-18-9-8-15-4-3-5-16(15)10-18/h6-11H,3-5,12-13H2,1-2H3,(H,23,24)