Nombre: tert-butyl 4-(2-chloro-5-nitrophenylamino)piperidine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC(Nc2cc([N+](=O)[O-])ccc2Cl)CC1Molecular Processing
Molecular formula
C16H22ClN3O4
Molecular weight
355.82
Exact mass
355.1299
XLogP
4.06
TPSA
84.71
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
92.56
Supplementary Information
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