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Home > Nitro Compounds > 88380-59-0
88380-59-0 | Benzamide, N-[5-methoxy-4-nitro-2-(phenylmethoxy)phenyl]-
CAS No: 88380-59-0 Catalog No: AG004M2H MDL No:
Product Description
Catalog Number:
AG004M2H
Chemical Name:
Benzamide, N-[5-methoxy-4-nitro-2-(phenylmethoxy)phenyl]-
CAS Number:
88380-59-0
Molecular Formula:
C21H18N2O5
Molecular Weight:
378.3780
IUPAC Name:
N-(5-methoxy-4-nitro-2-phenylmethoxyphenyl)benzamide
InChI:
InChI=1S/C21H18N2O5/c1-27-20-12-17(22-21(24)16-10-6-3-7-11-16)19(13-18(20)23(25)26)28-14-15-8-4-2-5-9-15/h2-13H,14H2,1H3,(H,22,24)
InChI Key:
JEBGEWFQUKNDIX-UHFFFAOYSA-N
SMILES:
COc1cc(NC(=O)c2ccccc2)c(cc1[N+](=O)[O-])OCc1ccccc1
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.122g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
378.384g/mol
Monoisotopic Mass:
378.122g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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