(4-ethylphenyl) (4E)-3-methyl-4-[(4-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: (4-ethylphenyl) (4E)-3-methyl-4-[(4-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (4-ethylphenyl) (4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(4-nitrophenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-ethylphenyl) ester Formula: C25H23N3O6 MolecularWeight: 461.46662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2=C(C3=C(O2)CCCC3=NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)C2=C(C\3=C(O2)CCC/C3=N\NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H23N3O6/c1-3-16-7-13-19(14-8-16)33-25(30)23-15(2)22-20(5-4-6-21(22)34-23)26-27-24(29)17-9-11-18(12-10-17)28(31)32/h7-14H,3-6H2,1-2H3,(H,27,29)/b26-20+