Name: ethyl 2-(3,4-dimethoxybenzoyl)-2-(dimethylaminomethylene)acetate
SMILES:
CCOC(=O)C(=CN(C)C)C(=O)c1ccc(OC)c(OC)c1Molecular Processing
Molecular formula
C16H21NO5
Molecular weight
307.35
Exact mass
307.142
XLogP
1.9
TPSA
65.07
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
82.28
Supplementary Information
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