methyl 3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-2-methyl-benzoate Openeye Name: methyl 3-[(5-bromo-2-fluoro-phenyl)methylamino]-2-methyl-benzoate CAS Name: 3-[(5-bromo-2-fluorophenyl)methylamino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(5-bromo-2-fluorophenyl)methylamino]-2-methylbenzoate Traditional Name: 3-[(5-bromo-2-fluoro-benzyl)amino]-2-methyl-benzoic acid methyl ester Formula: C16H15BrFNO2 MolecularWeight: 352.198203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=C(C=CC(=C2)Br)F)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NCC2=C(C=CC(=C2)Br)F)C(=O)OC

InChI

InChI=1S/C16H15BrFNO2/c1-10-13(16(20)21-2)4-3-5-15(10)19-9-11-8-12(17)6-7-14(11)18/h3-8,19H,9H2,1-2H3