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2856-37-3 | Butanamide, 2-(hydroxyimino)-N-1-naphthalenyl-3-oxo-
CAS No: 2856-37-3 Catalog No: AG002VPZ MDL No:
Product Description
Catalog Number:
AG002VPZ
Chemical Name:
Butanamide, 2-(hydroxyimino)-N-1-naphthalenyl-3-oxo-
CAS Number:
2856-37-3
Molecular Formula:
C14H12N2O3
Molecular Weight:
256.2567
IUPAC Name:
3-hydroxy-N-naphthalen-1-yl-2-nitrosobut-2-enamide
InChI:
InChI=1S/C14H12N2O3/c1-9(17)13(16-19)14(18)15-12-8-4-6-10-5-2-3-7-11(10)12/h2-8,17H,1H3,(H,15,18)
InChI Key:
CYWMAGLVKJDYEC-UHFFFAOYSA-N
SMILES:
ON=C(C(=O)Nc1cccc2c1cccc2)C(=O)C
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.261g/mol
Monoisotopic Mass:
256.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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