C=CCON=C(CCC)C1=C(O)CC(c2cc(C)cs2)CC1=O
SMILES: C=CCON=C(CCC)C1=C(O)CC(c2cc(C)cs2)CC1=O

Molecular Processing

Molecular formula
C18H23NO3S
Molecular weight
333.45
Exact mass
333.1399
XLogP
4.67
TPSA
58.89
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
94.18

Supplementary Information

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