COC=C(C(=O)OC)c1ccccc1COc1n[nH]cc1Cl
SMILES: COC=C(C(=O)OC)c1ccccc1COc1n[nH]cc1Cl

Molecular Processing

Molecular formula
C15H15ClN2O4
Molecular weight
322.75
Exact mass
322.072
XLogP
2.8
TPSA
73.44
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
81.37

Supplementary Information

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