O=[N+]([O-])c1cccc2cc(-c3ccccn3)[nH]c12
Name: 7-nitro-2-(pyridin-2-yl)-1H-indole
SMILES: O=[N+]([O-])c1cccc2cc(-c3ccccn3)[nH]c12

Molecular Processing

Molecular formula
C13H9N3O2
Molecular weight
239.23
Exact mass
239.0695
XLogP
3.14
TPSA
71.82
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
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
68.18

Supplementary Information

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