Name: Ethyl 3-(1,3-dioxo-1,3,4,5,6,7-hexahydro-isoindol-2-yl)-2-(2-methyl-[1,3]dioxolan-2-yl)propionate
SMILES:
CCOC(=O)C(CN1C(=O)C2=C(CCCC2)C1=O)C1(C)OCCO1Molecular Processing
Molecular formula
C17H23NO6
Molecular weight
337.37
Exact mass
337.1525
XLogP
1.17
TPSA
82.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
0
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.706
Molar refractivity
82.65
Supplementary Information
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Involved in 2 reactions→