Compound C32H31ClN2

2-(1-azatetracyclo[8.6.1.02,7.014,17]heptadeca-2,4,6,10,12,14(17),15-heptaen-16-yl)ethyl-dibenzylazanium chloride

CAS: 57529-84-7

Molecular Formula	`C32H31ClN2`
Molecular Weight	479.1 g/mol
Topological Polar Surface Area	9.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	1
Rotatable Bonds	7
Exact Mass	478.2176
Heavy Atoms	35
Complexity	601.0

Chemical Identifiers

CAS Number	57529-84-7
SMILES	`C1CC2=CC=CC3=C2N(C4=CC=CC=C41)C(=C3)CC[NH+](CC5=CC=CC=C5)CC6=CC=CC=C6.[Cl-]`
InChIKey	`IWBVOUPYRXFQPE-UHFFFAOYSA-N`

📖 Product Overview

Compound C32H31ClN2 (CAS: 57529-84-7) is a chemical compound with molecular formula C32H31ClN2 and molecular weight 479.1 g/mol. Its IUPAC systematic name is 2-(1-azatetracyclo[8.6.1.02,7.014,17]heptadeca-2,4,6,10,12,14(17),15-heptaen-16-yl)ethyl-dibenzylazanium chloride. Topological Polar Surface Area 9.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 1 Rotatable Bonds 7 Exact Mass 478.2176 Heavy Atoms 35 Complexity 601.0 InChI Key: IWBVOUPYRXFQPE-UHFFFAOYSA-N. SMILES: C1CC2=CC=CC3=C2N(C4=CC=CC=C41)C(=C3)CC[NH+](CC5=CC=CC=C5)CC6=CC=CC=C6.[Cl-].

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