Compound C28H35Cl2N3O

4-piperidin-1-ium-1-yl-1-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)ethyl]piperidin-1-ium-4-carboxamide dichloride

CAS: 73826-54-7

Molecular Formula	`C28H35Cl2N3O`
Molecular Weight	500.5 g/mol
Topological Polar Surface Area	52.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	499.21573
Heavy Atoms	34
Complexity	686.0

Chemical Identifiers

CAS Number	73826-54-7
SMILES	`C1CC[NH+](CC1)C2(CC[NH+](CC2)CC=C3C4=CC=CC=C4C=CC5=CC=CC=C53)C(=O)N.[Cl-].[Cl-]`
InChIKey	`UALOHGDWLWLPFB-UHFFFAOYSA-N`

📖 Product Overview

Compound C28H35Cl2N3O (CAS: 73826-54-7) is a chemical compound with molecular formula C28H35Cl2N3O and molecular weight 500.5 g/mol. Its IUPAC systematic name is 4-piperidin-1-ium-1-yl-1-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)ethyl]piperidin-1-ium-4-carboxamide dichloride. Topological Polar Surface Area 52.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 499.21573 Heavy Atoms 34 Complexity 686.0 InChI Key: UALOHGDWLWLPFB-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)C2(CC[NH+](CC2)CC=C3C4=CC=CC=C4C=CC5=CC=CC=C53)C(=O)N.[Cl-].[Cl-].

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