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Home > Nitro Compounds > 129228-01-9
129228-01-9 | Benzamide, 2,4,6-trihydroxy-3-nitro-N-(4-phenoxyphenyl)-
CAS No: 129228-01-9 Catalog No: AG000YZT MDL No:
Product Description
Catalog Number:
AG000YZT
Chemical Name:
Benzamide, 2,4,6-trihydroxy-3-nitro-N-(4-phenoxyphenyl)-
CAS Number:
129228-01-9
Molecular Formula:
C19H14N2O7
Molecular Weight:
382.3237
IUPAC Name:
2,4,6-trihydroxy-3-nitro-N-(4-phenoxyphenyl)benzamide
InChI:
InChI=1S/C19H14N2O7/c22-14-10-15(23)17(21(26)27)18(24)16(14)19(25)20-11-6-8-13(9-7-11)28-12-4-2-1-3-5-12/h1-10,22-24H,(H,20,25)
InChI Key:
SWRNFRDSVOHRAM-UHFFFAOYSA-N
SMILES:
O=C(c1c(O)cc(c(c1O)[N+](=O)[O-])O)Nc1ccc(cc1)Oc1ccccc1
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.08g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
382.328g/mol
Monoisotopic Mass:
382.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Novel approaches to the treatment of hepatitis C virus infection. | Antiviral chemistry & chemotherapy 20000301 |
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