C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])F
الاسم: N-(1,3-benzodioxol-5-ylmethyl)-2-fluoro-5-nitrobenzamide
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])F

Molecular Processing

Molecular formula
C15H11FN2O5
Molecular weight
318.26
Exact mass
318.0652
XLogP
2.39
TPSA
90.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
76.79

Supplementary Information

InChIKey: JYCLSEUMILHWGO-UHFFFAOYSA-N
مرادفات
SCHEMBL6940835JYCLSEUMILHWGO-UHFFFAOYSA-N2-fluoro-5-nitro-N-(1,3-benzodioxol-5-ylmethyl)benzamide
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