methyl 3-[4-aminocarbonyl-1-butyl-5-methyl-3-[3-(trifluoromethyloxy)phenyl]pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-1-butyl-5-methyl-3-[3-(trifluoromethyloxy)phenyl]pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-butyl-4-carbamoyl-5-methyl-3-[3-(trifluoromethoxy)phenyl]pyrrol-2-yl]propanoate CAS Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-[3-(trifluoromethoxy)phenyl]-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-butyl-4-carbamoyl-5-methyl-3-[3-(trifluoromethoxy)phenyl]pyrrol-2-yl]propanoate Traditional Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-[3-(trifluoromethoxy)phenyl]pyrrol-2-yl]propionic acid methyl ester Formula: C21H25F3N2O4 MolecularWeight: 426.42941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=CC(=CC=C2)OC(F)(F)F)C(=O)N)C

Isomeric SMILES

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=CC(=CC=C2)OC(F)(F)F)C(=O)N)C

InChI

InChI=1S/C21H25F3N2O4/c1-4-5-11-26-13(2)18(20(25)28)19(16(26)9-10-17(27)29-3)14-7-6-8-15(12-14)30-21(22,23)24/h6-8,12H,4-5,9-11H2,1-3H3,(H2,25,28)