2-[3-(dimethylamino)phenyl]-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-[3-(dimethylamino)phenyl]-3H-isoindol-2-ium-1-amine Openeye Name: 2-[3-(dimethylamino)phenyl]-3H-isoindol-2-ium-1-amine CAS Name: 2-[3-(dimethylamino)phenyl]-3H-isoindol-2-ium-1-amine IUPAC Name: 2-[3-(dimethylamino)phenyl]-3H-isoindol-2-ium-1-amine Traditional Name: [3-(3-amino-1H-isoindol-2-ium-2-yl)phenyl]-dimethyl-amine Formula: C16H18N3+ MolecularWeight: 252.33422

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)[N+]2=C(C3=CC=CC=C3C2)N

Isomeric SMILES

CN(C)C1=CC=CC(=C1)[N+]2=C(C3=CC=CC=C3C2)N

InChI

InChI=1S/C16H17N3/c1-18(2)13-7-5-8-14(10-13)19-11-12-6-3-4-9-15(12)16(19)17/h3-10,17H,11H2,1-2H3/p+1