Compound C15H20ClN3O2

3-(azepan-1-ium-1-ylmethyl)-6-nitro-1H-indole chloride

CAS: 101832-86-4

Molecular Formula	`C15H20ClN3O2`
Molecular Weight	309.79 g/mol
Topological Polar Surface Area	66.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	309.1244
Heavy Atoms	21
Complexity	337.0

Chemical Identifiers

CAS Number	101832-86-4
SMILES	`C1CCC[NH+](CC1)CC2=CNC3=C2C=CC(=C3)[N+](=O)[O-].[Cl-]`
InChIKey	`UWNMAXDIFWCFBC-UHFFFAOYSA-N`

📖 Product Overview

Compound C15H20ClN3O2 (CAS: 101832-86-4) is a chemical compound with molecular formula C15H20ClN3O2 and molecular weight 309.79 g/mol. Its IUPAC systematic name is 3-(azepan-1-ium-1-ylmethyl)-6-nitro-1H-indole chloride. Topological Polar Surface Area 66.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 309.1244 Heavy Atoms 21 Complexity 337.0 InChI Key: UWNMAXDIFWCFBC-UHFFFAOYSA-N. SMILES: C1CCC[NH+](CC1)CC2=CNC3=C2C=CC(=C3)[N+](=O)[O-].[Cl-].

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