2-[[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[3-[5-(2-fluorophenyl)-2-furyl]propanoylamino]methyl]-4-nitro-phenolate CAS Name: 2-[[[3-[5-(2-fluorophenyl)-2-furanyl]-1-oxopropyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]methyl]-4-nitrophenolate Traditional Name: 2-[[3-[5-(2-fluorophenyl)-2-furyl]propanoylamino]methyl]-4-nitro-phenolate Formula: C20H16FN2O5- MolecularWeight: 383.349843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)CCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)CCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-])F

InChI

InChI=1S/C20H17FN2O5/c21-17-4-2-1-3-16(17)19-9-6-15(28-19)7-10-20(25)22-12-13-11-14(23(26)27)5-8-18(13)24/h1-6,8-9,11,24H,7,10,12H2,(H,22,25)/p-1