الاسم: methyl 1-(2,3-dihydro-3-methyl-1H-inden-1-yl)-1H-imidazole-5-carboxylate mononitrate
SMILES:
COC(=O)c1cncn1C1CC(C)c2ccccc21.O=[N+]([O-])OMolecular Processing
Molecular formula
C15H17N3O5
Molecular weight
319.32
Exact mass
319.1168
XLogP
2.42
TPSA
107.49
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.333
Molar refractivity
79.96
Supplementary Information
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