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

Systemtic Name: (4-ethylphenyl) (4E)-3-methyl-4-[(3-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (4-ethylphenyl) (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(3-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(m-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-ethylphenyl) ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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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(=CC=C4)C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4/c1-4-18-11-13-20(14-12-18)31-26(30)24-17(3)23-21(9-6-10-22(23)32-24)27-28-25(29)19-8-5-7-16(2)15-19/h5,7-8,11-15H,4,6,9-10H2,1-3H3,(H,28,29)/b27-21+