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

Systemtic Name: 2-[(1S)-1-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine Openeye Name: 2-[(1S)-1-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine CAS Name: 2-[(1S)-1-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine IUPAC Name: 2-[(1S)-1-(2,4-dichlorophenyl)ethyl]-3H-isoindol-2-ium-1-amine Traditional Name: [2-[(1S)-1-(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:

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

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)Cl)Cl)[N+]2=C(C3=CC=CC=C3C2)N

InChI

InChI=1S/C16H14Cl2N2/c1-10(13-7-6-12(17)8-15(13)18)20-9-11-4-2-3-5-14(11)16(20)19/h2-8,10,19H,9H2,1H3/p+1/t10-/m0/s1