Name: tert-butyl 4-oxo-2a-(2-oxoethyl)-2a,3,4,5-tetrahydropyrrolo[4,3,2-de]quinolin-1(2H)-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CC2(CC=O)CC(=O)Nc3cccc1c32Molecular Processing
Molecular formula
C17H20N2O4
Molecular weight
316.36
Exact mass
316.1423
XLogP
2.61
TPSA
75.71
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
85.63
Supplementary Information
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