methyl 5-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoyloxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(2-indan-5-ylsulfanylacetyl)oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[2-(2,3-dihydro-1H-inden-5-ylthio)-1-oxoethoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[2-(indan-5-ylthio)acetyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H23NO5S/c1-12-19(21(25)26-3)13(2)22-20(12)17(23)10-27-18(24)11-28-16-8-7-14-5-4-6-15(14)9-16/h7-9,22H,4-6,10-11H2,1-3H3