CC(=O)Oc1c(C)c(C)c2c(c1C)C=CC(C)(COc1ccc([N+](=O)[O-])cc1)O2
Name: 6-acetoxy-2,5,7,8-tetramethyl-2-(4-nitrophenoxymethyl)-2H-chromene
SMILES: CC(=O)Oc1c(C)c(C)c2c(c1C)C=CC(C)(COc1ccc([N+](=O)[O-])cc1)O2

Molecular Processing

Molecular formula
C22H23NO6
Molecular weight
397.43
Exact mass
397.1525
XLogP
4.69
TPSA
87.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
108.62

Supplementary Information

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