methyl 5-[(2S)-2-(4-bromanyl-2-fluoranyl-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(2S)-2-(4-bromanyl-2-fluoranyl-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(2S)-2-(4-bromo-2-fluoro-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-(4-bromo-2-fluorophenoxy)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-2-(4-bromo-2-fluorophenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(4-bromo-2-fluoro-phenoxy)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17BrFNO4 MolecularWeight: 398.223583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H17BrFNO4/c1-8-14(17(22)23-4)9(2)20-15(8)16(21)10(3)24-13-6-5-11(18)7-12(13)19/h5-7,10,20H,1-4H3/t10-/m0/s1