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

Systemtic Name: methyl 2-[[(4E)-3-methyl-4-(2-phenylethanoylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(4E)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 2-[[[(4E)-3-methyl-4-[(1-oxo-2-phenylethyl)hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4E)-3-methyl-4-[(2-phenylacetyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 2-[[(4E)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoic acid methyl ester Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)CC3=CC=CC=C3)CCC2)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)CC3=CC=CC=C3)/CCC2)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C26H25N3O5/c1-16-23-20(28-29-22(30)15-17-9-4-3-5-10-17)13-8-14-21(23)34-24(16)25(31)27-19-12-7-6-11-18(19)26(32)33-2/h3-7,9-12H,8,13-15H2,1-2H3,(H,27,31)(H,29,30)/b28-20+