COC(=O)C1CC(=O)N(C1)C2=CC=CC(=C2)C=O
الاسم: methyl 1-(3-formylphenyl)-5-oxopyrrolidine-3-carboxylate
SMILES: COC(=O)C1CC(=O)N(C1)C2=CC=CC(=C2)C=O

Molecular Processing

Molecular formula
C13H13NO4
Molecular weight
247.25
Exact mass
247.0845
XLogP
1.02
TPSA
63.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
64.31

Supplementary Information

InChIKey: RXAITWAGSDGVFK-UHFFFAOYSA-N
مرادفات
RXAITWAGSDGVFK-UHFFFAOYSA-Nmethyl (3-formylphenyl)-5-oxopyrrolidine-3-carboxylate
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