CCOP(=O)(CNc1c(N)cc([N+](=O)[O-])c2ccccc12)OCC
名称: (2-amino-4-nitro-1-naphthylamino)-methanephosphonic acid diethyl ester
SMILES: CCOP(=O)(CNc1c(N)cc([N+](=O)[O-])c2ccccc12)OCC

Molecular Processing

Molecular formula
C15H20N3O5P
Molecular weight
353.32
Exact mass
353.1141
XLogP
3.97
TPSA
116.72
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
94.36

Supplementary Information

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