(4-fluorophenyl) (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: (4-fluorophenyl) (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (4-fluorophenyl) (4E)-4-[(2,4-dinitrophenyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-fluorophenyl) ester IUPAC Name: (4-fluorophenyl) (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(2,4-dinitrophenyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-fluorophenyl) ester Formula: C22H17FN4O7 MolecularWeight: 468.391383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])CCC2)C(=O)OC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/CCC2)C(=O)OC4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN4O7/c1-12-20-17(25-24-16-10-7-14(26(29)30)11-18(16)27(31)32)3-2-4-19(20)34-21(12)22(28)33-15-8-5-13(23)6-9-15/h5-11,24H,2-4H2,1H3/b25-17+