Name: 2-benzoyl-1-[2-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)ethyl]pyrrole
SMILES:
CC1(C)OC(=O)C(CCn2cccc2C(=O)c2ccccc2)C(=O)O1Molecular Processing
Molecular formula
C19H19NO5
Molecular weight
341.36
Exact mass
341.1263
XLogP
2.56
TPSA
74.6
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
88.68
Supplementary Information
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