COC=C1C(=O)N(C(C)=O)N(C(C)=O)c2ccccc21
Name: 1,2-diacetyl-4-methoxymethylene-1,4-dihydro-2H-cinnolin-3-one
SMILES: COC=C1C(=O)N(C(C)=O)N(C(C)=O)c2ccccc21

Molecular Processing

Molecular formula
C14H14N2O4
Molecular weight
274.28
Exact mass
274.0954
XLogP
1.33
TPSA
66.92
H-bond donors
0
H-bond acceptors
4
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
6
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
72.12

Supplementary Information

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