2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-amine Openeye Name: 2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-amine CAS Name: 2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-amine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-amine Traditional Name: [2-(1,3-benzodioxol-5-yl)-3H-isoindol-2-ium-1-yl]amine Formula: C15H13N2O2+ MolecularWeight: 253.27592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1C3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1C3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C15H12N2O2/c16-15-12-4-2-1-3-10(12)8-17(15)11-5-6-13-14(7-11)19-9-18-13/h1-7,16H,8-9H2/p+1