methyl 3-[3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]propanoate

Systemtic Name: methyl 3-[3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]propanoate Openeye Name: methyl 3-[3-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]propanoate CAS Name: 3-[3-[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[2-(4-bromo-2-fluorophenoxy)acetyl]-2,5-dimethylpyrrol-1-yl]propanoate Traditional Name: 3-[3-[2-(4-bromo-2-fluoro-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]propionic acid methyl ester Formula: C18H19BrFNO4 MolecularWeight: 412.250163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)COC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)COC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C18H19BrFNO4/c1-11-8-14(12(2)21(11)7-6-18(23)24-3)16(22)10-25-17-5-4-13(19)9-15(17)20/h4-5,8-9H,6-7,10H2,1-3H3