CC1=CC2=CC=CC=C2N(C1=O)CC3OCCO3
이름: 1-(1,3-dioxolan-2-ylmethyl)-3-methylquinolin-2-one
SMILES: CC1=CC2=CC=CC=C2N(C1=O)CC3OCCO3

Molecular Processing

Molecular formula
C14H15NO3
Molecular weight
245.28
Exact mass
245.1052
XLogP
1.68
TPSA
40.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
68.64

Supplementary Information

InChIKey: RIAIPZJAECLSNB-UHFFFAOYSA-N
동의어
SCHEMBL2793574RIAIPZJAECLSNB-UHFFFAOYSA-N1-(1,3-dioxolan-2-ylmethyl)-3-methylquinolin-2(1h)-one
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