3-phenyl-2-propyl-3H-isoindol-2-ium-1-amine

Systemtic Name: 3-phenyl-2-propyl-3H-isoindol-2-ium-1-amine Openeye Name: 3-phenyl-2-propyl-3H-isoindol-2-ium-1-amine CAS Name: 3-phenyl-2-propyl-3H-isoindol-2-ium-1-amine IUPAC Name: 3-phenyl-2-propyl-3H-isoindol-2-ium-1-amine Traditional Name: (3-phenyl-2-propyl-3H-isoindol-2-ium-1-yl)amine Formula: C17H19N2+ MolecularWeight: 251.34616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C2=CC=CC=C2C1C3=CC=CC=C3)N

Isomeric SMILES

CCC[N+]1=C(C2=CC=CC=C2C1C3=CC=CC=C3)N

InChI

InChI=1S/C17H18N2/c1-2-12-19-16(13-8-4-3-5-9-13)14-10-6-7-11-15(14)17(19)18/h3-11,16,18H,2,12H2,1H3/p+1