الاسم: ethyl 1-(4-nitro-2-cyanophenyl)piperidin-4-ylcarboxylate
SMILES:
CCOC(=O)C1CCN(c2ccc([N+](=O)[O-])cc2C#N)CC1Molecular Processing
Molecular formula
C15H17N3O4
Molecular weight
303.32
Exact mass
303.1219
XLogP
2.25
TPSA
96.47
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
79.38
Supplementary Information
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