N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-[2,4-bis(chloranyl)phenoxy]ethanamide bromide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-[2,4-bis(chloranyl)phenoxy]ethanamide bromide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(2,4-dichlorophenoxy)acetamide bromide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(2,4-dichlorophenoxy)acetamide bromide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(2,4-dichlorophenoxy)acetamide bromide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(2,4-dichlorophenoxy)acetamide bromide Formula: C16H14BrCl2N3O2 MolecularWeight: 431.11126

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1NC(=O)COC3=C(C=C(C=C3)Cl)Cl)N.[Br-]

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1NC(=O)COC3=C(C=C(C=C3)Cl)Cl)N.[Br-]

InChI

InChI=1S/C16H13Cl2N3O2.BrH/c17-11-5-6-14(13(18)7-11)23-9-15(22)20-21-8-10-3-1-2-4-12(10)16(21)19;/h1-7,19H,8-9H2,(H,20,22);1H