(4-bromanyl-2-fluoranyl-phenyl)methyl 2-[(4-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-[(4-methylphenyl)carbonylamino]ethanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-[(4-methylbenzoyl)amino]acetate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]acetic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-[(4-methylbenzoyl)amino]acetate Traditional Name: 2-(p-toluoylamino)acetic acid (4-bromo-2-fluoro-benzyl) ester Formula: C17H15BrFNO3 MolecularWeight: 380.208303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H15BrFNO3/c1-11-2-4-12(5-3-11)17(22)20-9-16(21)23-10-13-6-7-14(18)8-15(13)19/h2-8H,9-10H2,1H3,(H,20,22)