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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC2=CC(=C(C=C2)F)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC2=CC(=C(C=C2)F)Br

InChI

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