SMILES:
CCCCC1=C(N(CC)CC)c2cc3c(cc2C1)OCO3Molecular Processing
Molecular formula
C18H25NO2
Molecular weight
287.4
Exact mass
287.1885
XLogP
4.21
TPSA
21.7
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
85.64
Supplementary Information
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