1-isoquinolin-5-yl-1-(2-methylbutyl)piperidin-1-ium-3-amine

Systemtic Name: 1-isoquinolin-5-yl-1-(2-methylbutyl)piperidin-1-ium-3-amine Openeye Name: 1-(5-isoquinolyl)-1-(2-methylbutyl)piperidin-1-ium-3-amine CAS Name: 1-(5-isoquinolinyl)-1-(2-methylbutyl)-3-piperidin-1-iumamine IUPAC Name: 1-isoquinolin-5-yl-1-(2-methylbutyl)piperidin-1-ium-3-amine Traditional Name: [1-(5-isoquinolyl)-1-(2-methylbutyl)piperidin-1-ium-3-yl]amine Formula: C19H28N3+ MolecularWeight: 298.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[N+]1(CCCC(C1)N)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCC(C)C[N+]1(CCCC(C1)N)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H28N3/c1-3-15(2)13-22(11-5-7-17(20)14-22)19-8-4-6-16-12-21-10-9-18(16)19/h4,6,8-10,12,15,17H,3,5,7,11,13-14,20H2,1-2H3/q+1