2-diethylaminoethyl 2-[5-fluoranyl-2-[2-(3-nitrophenyl)ethanoylamino]phenoxy]ethanoate

Systemtic Name: 2-diethylaminoethyl 2-[5-fluoranyl-2-[2-(3-nitrophenyl)ethanoylamino]phenoxy]ethanoate Openeye Name: 2-diethylaminoethyl 2-[5-fluoro-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetate CAS Name: 2-[5-fluoro-2-[[2-(3-nitrophenyl)-1-oxoethyl]amino]phenoxy]acetic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-[5-fluoro-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetate Traditional Name: 2-[5-fluoro-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetic acid 2-diethylaminoethyl ester Formula: C22H26FN3O6 MolecularWeight: 447.456743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)COC1=C(C=CC(=C1)F)NC(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCOC(=O)COC1=C(C=CC(=C1)F)NC(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H26FN3O6/c1-3-25(4-2)10-11-31-22(28)15-32-20-14-17(23)8-9-19(20)24-21(27)13-16-6-5-7-18(12-16)26(29)30/h5-9,12,14H,3-4,10-11,13,15H2,1-2H3,(H,24,27)