2-[5-fluoranyl-4-morpholin-4-yl-2-[2-(3-nitrophenyl)ethanoylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-4-morpholin-4-yl-2-[2-(3-nitrophenyl)ethanoylamino]phenoxy]ethanoic acid Openeye Name: 2-[5-fluoro-4-morpholino-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetic acid CAS Name: 2-[5-fluoro-4-(4-morpholinyl)-2-[[2-(3-nitrophenyl)-1-oxoethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[5-fluoro-4-morpholin-4-yl-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetic acid Traditional Name: 2-[5-fluoro-4-morpholino-2-[[2-(3-nitrophenyl)acetyl]amino]phenoxy]acetic acid Formula: C20H20FN3O7 MolecularWeight: 433.387103

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2F)OCC(=O)O)NC(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2F)OCC(=O)O)NC(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20FN3O7/c21-15-10-18(31-12-20(26)27)16(11-17(15)23-4-6-30-7-5-23)22-19(25)9-13-2-1-3-14(8-13)24(28)29/h1-3,8,10-11H,4-7,9,12H2,(H,22,25)(H,26,27)