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89151-58-6 | Benzamide, N-[3-(1,1-diethyl-2-propenyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS No: 89151-58-6 Catalog No: AG003WS8 MDL No:
Product Description
Catalog Number:
AG003WS8
Chemical Name:
Benzamide, N-[3-(1,1-diethyl-2-propenyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS Number:
89151-58-6
Molecular Formula:
C19H24N2O4
Molecular Weight:
344.4049
IUPAC Name:
N-[3-(3-ethylpent-1-en-3-yl)-1,2-oxazol-5-yl]-2,6-dimethoxybenzamide
InChI:
InChI=1S/C19H24N2O4/c1-6-19(7-2,8-3)15-12-16(25-21-15)20-18(22)17-13(23-4)10-9-11-14(17)24-5/h6,9-12H,1,7-8H2,2-5H3,(H,20,22)
InChI Key:
JFMAGORHGLZLHC-UHFFFAOYSA-N
SMILES:
CCC(c1noc(c1)NC(=O)c1c(OC)cccc1OC)(C=C)CC
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.174g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.411g/mol
Monoisotopic Mass:
344.174g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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