Name: (Z)-1-(3-nitro-4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl) ethene
SMILES:
COc1ccc(/C=C\c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C18H19NO6
Molecular weight
345.35
Exact mass
345.1212
XLogP
3.8
TPSA
80.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
94.67
Supplementary Information
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