Compound C16H21Cl2NO

7-chloro-2-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one chloride

CAS: 93017-48-2

Molecular Formula	`C16H21Cl2NO`
Molecular Weight	314.2 g/mol
Topological Polar Surface Area	21.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	313.1
Heavy Atoms	20
Complexity	327.0

Chemical Identifiers

CAS Number	93017-48-2
SMILES	`C1CC[NH+](CC1)CC2CCC3=C(C2=O)C=C(C=C3)Cl.[Cl-]`
InChIKey	`PRUNLTQWACWKOG-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H21Cl2NO (CAS: 93017-48-2) is a chemical compound with molecular formula C16H21Cl2NO and molecular weight 314.2 g/mol. Its IUPAC systematic name is 7-chloro-2-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one chloride. Topological Polar Surface Area 21.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 2 Exact Mass 313.1 Heavy Atoms 20 Complexity 327.0 InChI Key: PRUNLTQWACWKOG-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)CC2CCC3=C(C2=O)C=C(C=C3)Cl.[Cl-].

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