Nombre: 2-[2-(2-chlorophenyl)ethenyl]-5-nitro-1H-indole
SMILES:
C1=CC=C(C(=C1)C=CC2=CC3=C(N2)C=CC(=C3)[N+](=O)[O-])ClMolecular Processing
Molecular formula
C16H11ClN2O2
Molecular weight
298.73
Exact mass
298.0509
XLogP
4.9
TPSA
58.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
85.33
Supplementary Information
InChIKey: SLRJOYSTPBDCEU-UHFFFAOYSA-N
Sinónimos
SCHEMBL5828903SLRJOYSTPBDCEU-UHFFFAOYSA-N2-[2-(2-Chlorophenyl)ethenyl]-5-nitro-1H-indole
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