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4-pyren-1-ylbutylazanium chloride

4-pyren-1-ylbutylazanium chloride

Systemtic Name:4-pyren-1-ylbutylazanium chloride
Openeye Name:4-pyren-1-ylbutylammonium chloride
CAS Name:4-(1-pyrenyl)butylammonium chloride
IUPAC Name:4-pyren-1-ylbutylazanium chloride
Traditional Name:4-pyren-1-ylbutylammonium chloride
Formula: C20H20ClN
MolecularWeight: 309.8325
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCC[NH3+].[Cl-]


Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCC[NH3+].[Cl-]


InChI

InChI=1S/C20H19N.ClH/c21-13-2-1-4-14-7-8-17-10-9-15-5-3-6-16-11-12-18(14)20(17)19(15)16;/h3,5-12H,1-2,4,13,21H2;1H


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