4-pyren-1-ylbutylazanium

Systemtic Name: 4-pyren-1-ylbutylazanium Openeye Name: 4-pyren-1-ylbutylammonium CAS Name: 4-(1-pyrenyl)butylammonium IUPAC Name: 4-pyren-1-ylbutylazanium Traditional Name: 4-pyren-1-ylbutylammonium Formula: C20H20N+ MolecularWeight: 274.3795

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N/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/p+1