methyl 4-[2,5-dimethyl-3-[2-(2-thiophen-2-ylethanoyloxy)ethanoyl]pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[2,5-dimethyl-3-[2-(2-thiophen-2-ylethanoyloxy)ethanoyl]pyrrol-1-yl]benzoate Openeye Name: methyl 4-[2,5-dimethyl-3-[2-[2-(2-thienyl)acetyl]oxyacetyl]pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dimethyl-3-[1-oxo-2-(1-oxo-2-thiophen-2-ylethoxy)ethyl]-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2,5-dimethyl-3-[2-(2-thiophen-2-ylacetyl)oxyacetyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2,5-dimethyl-3-[2-[2-(2-thienyl)acetyl]oxyacetyl]pyrrol-1-yl]benzoic acid methyl ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C(=O)COC(=O)CC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C(=O)COC(=O)CC3=CC=CS3

InChI

InChI=1S/C22H21NO5S/c1-14-11-19(20(24)13-28-21(25)12-18-5-4-10-29-18)15(2)23(14)17-8-6-16(7-9-17)22(26)27-3/h4-11H,12-13H2,1-3H3