(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-[(4-fluorobenzoyl)amino]acetate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]acetic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-[(4-fluorobenzoyl)amino]acetate Traditional Name: 2-[(4-fluorobenzoyl)amino]acetic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C18H15BrFNO5 MolecularWeight: 424.217803

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)CNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)CNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15BrFNO5/c19-14-8-16-15(24-5-6-25-16)7-12(14)10-26-17(22)9-21-18(23)11-1-3-13(20)4-2-11/h1-4,7-8H,5-6,9-10H2,(H,21,23)