ethyl 4-[[(4E)-3-methyl-4-(pyridin-3-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(4E)-3-methyl-4-(pyridin-3-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(4E)-3-methyl-4-(pyridine-3-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[(4E)-3-methyl-4-[[oxo(3-pyridinyl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(4E)-3-methyl-4-(pyridine-3-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[(4E)-3-methyl-4-(nicotinoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoic acid ethyl ester Formula: C25H24N4O5 MolecularWeight: 460.48186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(O2)CCCC3=NNC(=O)C4=CN=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H24N4O5/c1-3-33-25(32)16-9-11-18(12-10-16)27-24(31)22-15(2)21-19(7-4-8-20(21)34-22)28-29-23(30)17-6-5-13-26-14-17/h5-6,9-14H,3-4,7-8H2,1-2H3,(H,27,31)(H,29,30)/b28-19+