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

Systemtic Name: 2-butyl-3-phenyl-3H-isoindol-2-ium-1-amine Openeye Name: 2-butyl-3-phenyl-3H-isoindol-2-ium-1-amine CAS Name: 2-butyl-3-phenyl-3H-isoindol-2-ium-1-amine IUPAC Name: 2-butyl-3-phenyl-3H-isoindol-2-ium-1-amine Traditional Name: (2-butyl-3-phenyl-3H-isoindol-2-ium-1-yl)amine Formula: C18H21N2+ MolecularWeight: 265.37274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2/c1-2-3-13-20-17(14-9-5-4-6-10-14)15-11-7-8-12-16(15)18(20)19/h4-12,17,19H,2-3,13H2,1H3/p+1