2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-piperonyl-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H18NO2+ MolecularWeight: 268.33032

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H17NO2/c1-2-4-15-11-18(8-7-14(15)3-1)10-13-5-6-16-17(9-13)20-12-19-16/h1-6,9H,7-8,10-12H2/p+1