prop-2-enyl 2-[4-acetamido-2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]phenoxy]ethanoate

Systemtic Name: prop-2-enyl 2-[4-acetamido-2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]phenoxy]ethanoate Openeye Name: allyl 2-[4-acetamido-2-[(4-bromo-2-fluoro-phenyl)methylcarbamoyl]phenoxy]acetate CAS Name: 2-[4-acetamido-2-[[(4-bromo-2-fluorophenyl)methylamino]-oxomethyl]phenoxy]acetic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[4-acetamido-2-[(4-bromo-2-fluorophenyl)methylcarbamoyl]phenoxy]acetate Traditional Name: 2-[4-acetamido-2-[(4-bromo-2-fluoro-benzyl)carbamoyl]phenoxy]acetic acid allyl ester Formula: C21H20BrFN2O5 MolecularWeight: 479.296303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OCC(=O)OCC=C)C(=O)NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OCC(=O)OCC=C)C(=O)NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C21H20BrFN2O5/c1-3-8-29-20(27)12-30-19-7-6-16(25-13(2)26)10-17(19)21(28)24-11-14-4-5-15(22)9-18(14)23/h3-7,9-10H,1,8,11-12H2,2H3,(H,24,28)(H,25,26)