CC1=CC(=O)N(C2=C1C=CC(=C2)OC)CC=O
Nom: 2-(7-methoxy-4-methyl-2-oxoquinolin-1-yl)acetaldehyde
SMILES: CC1=CC(=O)N(C2=C1C=CC(=C2)OC)CC=O

Molecular Processing

Molecular formula
C13H13NO3
Molecular weight
231.25
Exact mass
231.0895
XLogP
1.52
TPSA
48.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
65.56

Supplementary Information

InChIKey: XMVXDGIULLGRTP-UHFFFAOYSA-N
Synonymes
SCHEMBL2796905XMVXDGIULLGRTP-UHFFFAOYSA-N(7-methoxy-4-methyl-2-oxoquinolin-1(2H)-yl)acetaldehyde
Voir la source →
Impliqué dans 25 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→