ethyl 1-(4,4-diphenylbut-3-enyl)-4-phenylpiperidin-1-ium-4-carboxylate chloride

CAS: 14106-90-2

Molecular Formula	`C30H34ClNO2`
Molecular Weight	476.0 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	9
Exact Mass	475.2278
Heavy Atoms	34
Complexity	595.0

Chemical Identifiers

CAS Number	14106-90-2
SMILES	`CCOC(=O)C1(CC[NH+](CC1)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]`
InChIKey	`OSOPBCVPYLWOCU-UHFFFAOYSA-N`

📖 Product Overview

ethyl 1-(4,4-diphenylbut-3-enyl)-4-phenylpiperidin-1-ium-4-carboxylate chloride (CAS: 14106-90-2) is a chemical compound with molecular formula C30H34ClNO2 and molecular weight 476.0 g/mol. Its IUPAC systematic name is ethyl 1-(4,4-diphenylbut-3-enyl)-4-phenylpiperidin-1-ium-4-carboxylate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 9 Exact Mass 475.2278 Heavy Atoms 34 Complexity 595.0 InChI Key: OSOPBCVPYLWOCU-UHFFFAOYSA-N. SMILES: CCOC(=O)C1(CC[NH+](CC1)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].

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