Name: 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-1-methyl-3H-imidazol-1-ium iodide
SMILES:
C[n+]1ccn(C(=O)N2CCCc3ccccc32)c1.[I-]Molecular Processing
Molecular formula
C14H16IN3O
Molecular weight
369.21
Exact mass
369.0338
XLogP
-1.26
TPSA
29.12
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.286
Molar refractivity
68.51
Supplementary Information
Details werden geladen…
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