5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 5-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H22N2 MolecularWeight: 242.35928

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-][NH+]1CCC2=C(C1)C=CC=C2CN3CC4CC4C3

Isomeric SMILES

[CH2-][NH+]1CCC2=C(C1)C=CC=C2CN3CC4CC4C3

InChI

InChI=1S/C16H22N2/c1-17-6-5-16-12(8-17)3-2-4-13(16)9-18-10-14-7-15(14)11-18/h2-4,14-15,17H,1,5-11H2