2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-amine; propan-2-ol; bromide

Systemtic Name: 2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-amine; propan-2-ol; bromide Openeye Name: 2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-amine; propan-2-ol; bromide CAS Name: 2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-amine; 2-propanol; bromide IUPAC Name: 2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-amine; propan-2-ol; bromide Traditional Name: [2-(3,4-dichlorophenyl)-3H-isoindol-2-ium-1-yl]amine; propan-2-ol; bromide Formula: C17H19BrCl2N2O MolecularWeight: 418.15556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.C1C2=CC=CC=C2C(=[N+]1C3=CC(=C(C=C3)Cl)Cl)N.[Br-]

Isomeric SMILES

CC(C)O.C1C2=CC=CC=C2C(=[N+]1C3=CC(=C(C=C3)Cl)Cl)N.[Br-]

InChI

InChI=1S/C14H10Cl2N2.C3H8O.BrH/c15-12-6-5-10(7-13(12)16)18-8-9-3-1-2-4-11(9)14(18)17;1-3(2)4;/h1-7,17H,8H2;3-4H,1-2H3;1H