CC1CC(Oc2ccc([N+](=O)[O-])cc2Cl)CCN1C(=O)OC(C)(C)C
Nombre: 4-(1-t-butoxycarbonyl-2-methylpiperidin-4-yloxy)-3-chloronitrobenzene
SMILES: CC1CC(Oc2ccc([N+](=O)[O-])cc2Cl)CCN1C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C17H23ClN2O5
Molecular weight
370.83
Exact mass
370.1295
XLogP
4.42
TPSA
81.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
94.16

Supplementary Information

Obteniendo detalles…

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