이름: ethyl 6-benzyloxy-4-hydroxy-6-methyl-5,6,7,8-tetrahydroquinoline-3-carboxylate
SMILES:
CCOC(=O)c1cnc2c(c1O)CC(C)(OCc1ccccc1)CC2Molecular Processing
Molecular formula
C20H23NO4
Molecular weight
341.41
Exact mass
341.1627
XLogP
3.43
TPSA
68.65
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
93.52
Supplementary Information
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