COC(=O)c1ccc2c(c1)C(C)=CC(C)(C)N2C(C)=O
名称: 1-acetyl-1,2-dihydro-2,2,4-trimethylquinoline-6-carboxylic acid methyl ester
SMILES: COC(=O)c1ccc2c(c1)C(C)=CC(C)(C)N2C(C)=O

Molecular Processing

Molecular formula
C16H19NO3
Molecular weight
273.33
Exact mass
273.1365
XLogP
3.02
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
78.67

Supplementary Information

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