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

Systemtic Name: (4-chloranyl-3-methyl-phenyl) (4E)-3-methyl-4-[(4-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (4-chloro-3-methyl-phenyl) (4E)-3-methyl-4-[(4-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(4-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) (4E)-3-methyl-4-[(4-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(p-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-chloro-3-methyl-phenyl) ester Formula: C25H23ClN2O4 MolecularWeight: 450.91412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)OC4=CC(=C(C=C4)Cl)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)OC4=CC(=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H23ClN2O4/c1-14-7-9-17(10-8-14)24(29)28-27-20-5-4-6-21-22(20)16(3)23(32-21)25(30)31-18-11-12-19(26)15(2)13-18/h7-13H,4-6H2,1-3H3,(H,28,29)/b27-20+