methyl 5-bromanyl-3-fluoranyl-2-(2-methylpropylamino)benzoate

Systemtic Name: methyl 5-bromanyl-3-fluoranyl-2-(2-methylpropylamino)benzoate Openeye Name: methyl 5-bromo-3-fluoro-2-(isobutylamino)benzoate CAS Name: 5-bromo-3-fluoro-2-(2-methylpropylamino)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-3-fluoro-2-(2-methylpropylamino)benzoate Traditional Name: 5-bromo-3-fluoro-2-(isobutylamino)benzoic acid methyl ester Formula: C12H15BrFNO2 MolecularWeight: 304.155403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(C=C(C=C1C(=O)OC)Br)F

Isomeric SMILES

CC(C)CNC1=C(C=C(C=C1C(=O)OC)Br)F

InChI

InChI=1S/C12H15BrFNO2/c1-7(2)6-15-11-9(12(16)17-3)4-8(13)5-10(11)14/h4-5,7,15H,6H2,1-3H3