methyl 3-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]benzoate

Systemtic Name: methyl 3-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]benzoate Openeye Name: methyl 3-[1-(3-bromo-4-fluoro-phenyl)ethylamino]benzoate CAS Name: 3-[1-(3-bromo-4-fluorophenyl)ethylamino]benzoic acid methyl ester IUPAC Name: methyl 3-[1-(3-bromo-4-fluorophenyl)ethylamino]benzoate Traditional Name: 3-[1-(3-bromo-4-fluoro-phenyl)ethylamino]benzoic acid methyl ester Formula: C16H15BrFNO2 MolecularWeight: 352.198203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Br)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)Br)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H15BrFNO2/c1-10(11-6-7-15(18)14(17)9-11)19-13-5-3-4-12(8-13)16(20)21-2/h3-10,19H,1-2H3