CCN(CCN1CCOc2cc([N+](=O)[O-])ccc21)C(=O)OC(C)(C)C
Name: tert-butyl ethyl(2-(7-nitro-2H-benzo[b][1,4]oxazin-4(3H)-yl)ethyl)carbamate
SMILES: CCN(CCN1CCOc2cc([N+](=O)[O-])ccc21)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C17H25N3O5
Molecular weight
351.4
Exact mass
351.1794
XLogP
3.05
TPSA
85.15
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
94.29

Supplementary Information

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