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1-butylisoquinolin-2-ium-3-amine

1-butylisoquinolin-2-ium-3-amine

Systemtic Name:1-butylisoquinolin-2-ium-3-amine
Openeye Name:1-butylisoquinolin-2-ium-3-amine
CAS Name:1-butyl-3-isoquinolin-2-iumamine
IUPAC Name:1-butylisoquinolin-2-ium-3-amine
Traditional Name:(1-butylisoquinolin-2-ium-3-yl)amine
Formula: C13H17N2+
MolecularWeight: 201.28748
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[NH+]C(=CC2=CC=CC=C21)N


Isomeric SMILES

CCCCC1=[NH+]C(=CC2=CC=CC=C21)N


InChI

InChI=1S/C13H16N2/c1-2-3-8-12-11-7-5-4-6-10(11)9-13(14)15-12/h4-7,9H,2-3,8H2,1H3,(H2,14,15)/p+1


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