Name: 2-(1-methyl-7-nitro-1H-indol-3-yl)-acetimidic acid isopropyl ester hydrochloride
SMILES:
CC(C)OC(=N)Cc1cn(C)c2c([N+](=O)[O-])cccc12.ClMolecular Processing
Molecular formula
C14H18ClN3O3
Molecular weight
311.77
Exact mass
311.1037
XLogP
3.45
TPSA
81.15
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.357
Molar refractivity
84.47
Supplementary Information
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