2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine Openeye Name: 2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine CAS Name: 2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine IUPAC Name: 2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine Traditional Name: [2-[2-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-yl]amine Formula: C16H15Cl2N2+ MolecularWeight: 306.2097

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1CCC3=C(C=C(C=C3)Cl)Cl)N

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1CCC3=C(C=C(C=C3)Cl)Cl)N

InChI

InChI=1S/C16H14Cl2N2/c17-13-6-5-11(15(18)9-13)7-8-20-10-12-3-1-2-4-14(12)16(20)19/h1-6,9,19H,7-8,10H2/p+1