SMILES:
COC(=O)/C=C/c1ccc2c(c1)C(=O)N(C)C1(CCNCC1)O2.ClMolecular Processing
Molecular formula
C17H21ClN2O4
Molecular weight
352.82
Exact mass
352.119
XLogP
1.84
TPSA
67.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.412
Molar refractivity
92.3
Supplementary Information
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