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

Systemtic Name: methyl 4-[[(4E)-4-(furan-2-ylcarbonylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[(4E)-4-(furan-2-carbonylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[(4E)-4-[[2-furanyl(oxo)methyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4E)-4-(furan-2-carbonylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[(4E)-4-(2-furoylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoic acid methyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CO3)CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CO3)/CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H21N3O6/c1-13-19-16(25-26-21(27)18-7-4-12-31-18)5-3-6-17(19)32-20(13)22(28)24-15-10-8-14(9-11-15)23(29)30-2/h4,7-12H,3,5-6H2,1-2H3,(H,24,28)(H,26,27)/b25-16+