CC(=O)OCC=CCN(CC1=CC=CC=C1)CC2=CC=CC=C2
Name: 4-(dibenzylamino)but-2-enyl acetate
SMILES: CC(=O)OCC=CCN(CC1=CC=CC=C1)CC2=CC=CC=C2

Molecular Processing

Molecular formula
C20H23NO2
Molecular weight
309.41
Exact mass
309.1729
XLogP
3.81
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
92.77

Supplementary Information

InChIKey: FBADMBMIILYFGO-UHFFFAOYSA-N
Synonyme
SCHEMBL8967612FBADMBMIILYFGO-UHFFFAOYSA-N1-acetoxy-4-dibenzylamino-2-butene
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