(4-bromanyl-2-fluoranyl-phenyl)methyl 2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-[(3,4,5-trimethoxybenzoyl)amino]acetate CAS Name: 2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]acetic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-[(3,4,5-trimethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4,5-trimethoxybenzoyl)amino]acetic acid (4-bromo-2-fluoro-benzyl) ester Formula: C19H19BrFNO6 MolecularWeight: 456.259663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)OCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)OCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C19H19BrFNO6/c1-25-15-6-12(7-16(26-2)18(15)27-3)19(24)22-9-17(23)28-10-11-4-5-13(20)8-14(11)21/h4-8H,9-10H2,1-3H3,(H,22,24)