C=CCC(C(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2
Nom: benzyl N-[(2R)-1-oxo-1-phenylpent-4-en-2-yl]carbamate
SMILES: C=CCC(C(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Molecular Processing

Molecular formula
C19H19NO3
Molecular weight
309.37
Exact mass
309.1365
XLogP
3.74
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
89.14

Supplementary Information

InChIKey: BNMGAWSBNBXRFM-QGZVFWFLSA-N
Synonymes
BNMGAWSBNBXRFM-QGZVFWFLSA-N(R)-benzyl 1-oxo-1-phenylpent-4-en-2-ylcarbamate
Voir la source →
Impliqué dans 2 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→