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

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) (4E)-3-methyl-4-[(2-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) (4E)-3-methyl-4-[(2-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(2-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) (4E)-3-methyl-4-[(2-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(o-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C26H25ClN2O4 MolecularWeight: 464.9407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)OC4=CC(=C(C(=C4)C)Cl)C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)OC4=CC(=C(C(=C4)C)Cl)C)C

InChI

InChI=1S/C26H25ClN2O4/c1-14-8-5-6-9-19(14)25(30)29-28-20-10-7-11-21-22(20)17(4)24(33-21)26(31)32-18-12-15(2)23(27)16(3)13-18/h5-6,8-9,12-13H,7,10-11H2,1-4H3,(H,29,30)/b28-20+