methyl 2-[(2-hydroxy-3-nitro-6,7,8,9-tetrahydrodibenzofuran-1-yl)methylideneamino]benzoate
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methyl 2-[(2-hydroxy-3-nitro-6,7,8,9-tetrahydrodibenzofuran-1-yl)methylideneamino]benzoate
structure -
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CAS No:
326028-07-3
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Formula:
C21H18N2O6
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Chemical Name:
methyl 2-[(2-hydroxy-3-nitro-6,7,8,9-tetrahydrodibenzofuran-1-yl)methylideneamino]benzoate
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Synonyms:
Oprea1_362807;ZINC16194286;AKOS003671404;MCULE-9580372414;ST51008390;Z56779833;326028-07-3;methyl 2-[({4-hydroxy-5-nitro-8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraen-3-yl}methylidene)amino]benzoate;methyl 2-[(1Z)-2-(8-hydroxy-7-nitro(1,2,3,4-tetrahydrobenzo[2,1-d]benzo[b]fura n-9-yl))-1-azavinyl]benzoate
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CAS No:
methyl 2-[(2-hydroxy-3-nitro-6,7,8,9-tetrahydrodibenzofuran-1-yl)methylideneamino]benzoate Basic Attributes
394.4 g/mol
394.11648630 g/mol
Computed Properties
Molecular Weight:394.4
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:394.11648630
Monoisotopic Mass:394.11648630
Topological Polar Surface Area:118
Heavy Atom Count:29
Complexity:650
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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