이름: 6',7'-dimethoxy-2'-ethoxycarbonylspiro[benzofuran-2(3H),4'(2'H)-isoquinoline]
SMILES:
CCOC(=O)N1Cc2cc(OC)c(OC)cc2C2(Cc3ccccc3O2)C1Molecular Processing
Molecular formula
C21H23NO5
Molecular weight
369.42
Exact mass
369.1576
XLogP
3.51
TPSA
57.23
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
99.43
Supplementary Information
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