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

Systemtic Name: methyl 3-[1-(3-bromophenyl)ethylamino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[1-(3-bromophenyl)ethylamino]-4-fluoro-benzoate CAS Name: 3-[1-(3-bromophenyl)ethylamino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[1-(3-bromophenyl)ethylamino]-4-fluorobenzoate Traditional Name: 3-[1-(3-bromophenyl)ethylamino]-4-fluoro-benzoic acid methyl ester Formula: C16H15BrFNO2 MolecularWeight: 352.198203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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