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82559-00-0 | Benzamide, N-[3-(1-ethyl-1-methylpentyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS No: 82559-00-0 Catalog No: AG00572P MDL No:
Product Description
Catalog Number:
AG00572P
Chemical Name:
Benzamide, N-[3-(1-ethyl-1-methylpentyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS Number:
82559-00-0
Molecular Formula:
C20H28N2O4
Molecular Weight:
360.4473
IUPAC Name:
2,6-dimethoxy-N-[3-(3-methylheptan-3-yl)-1,2-oxazol-5-yl]benzamide
InChI:
InChI=1S/C20H28N2O4/c1-6-8-12-20(3,7-2)16-13-17(26-22-16)21-19(23)18-14(24-4)10-9-11-15(18)25-5/h9-11,13H,6-8,12H2,1-5H3,(H,21,23)
InChI Key:
ZIOODIQBPHTOIE-UHFFFAOYSA-N
SMILES:
CCCCC(c1noc(c1)NC(=O)c1c(OC)cccc1OC)(CC)C
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.205g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.454g/mol
Monoisotopic Mass:
360.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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