methyl 3-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]-2-methyl-benzoate Openeye Name: methyl 3-[(3-bromo-4-fluoro-phenyl)methylamino]-2-methyl-benzoate CAS Name: 3-[(3-bromo-4-fluorophenyl)methylamino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(3-bromo-4-fluorophenyl)methylamino]-2-methylbenzoate Traditional Name: 3-[(3-bromo-4-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=CC(=C(C=C2)F)Br)C(=O)OC

Isomeric SMILES

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

InChI

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