2-[1,3-benzodioxol-5-ylmethyl-[(2-fluorophenyl)methyl]amino]ethylazanium

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2-fluorophenyl)methyl]amino]ethylazanium Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2-fluorophenyl)methyl]amino]ethylammonium CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2-fluorophenyl)methyl]amino]ethylammonium IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2-fluorophenyl)methyl]amino]ethylazanium Traditional Name: 2-[(2-fluorobenzyl)-piperonyl-amino]ethylammonium Formula: C17H20FN2O2+ MolecularWeight: 303.351303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CC[NH3+])CC3=CC=CC=C3F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CC[NH3+])CC3=CC=CC=C3F

InChI

InChI=1S/C17H19FN2O2/c18-15-4-2-1-3-14(15)11-20(8-7-19)10-13-5-6-16-17(9-13)22-12-21-16/h1-6,9H,7-8,10-12,19H2/p+1