Name: methyl 4,5-methylenedioxy-2-(3-methyl-4-nitrobenzoyl)phenylacetate
SMILES:
COC(=O)Cc1cc2c(cc1C(=O)c1ccc([N+](=O)[O-])c(C)c1)OCO2Molecular Processing
Molecular formula
C18H15NO7
Molecular weight
357.32
Exact mass
357.0849
XLogP
2.58
TPSA
104.97
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
26
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
0.222
Molar refractivity
89.55
Supplementary Information
Details werden geladen…
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