N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-phenyl-ethanamide bromide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-phenyl-ethanamide bromide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-phenyl-acetamide bromide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-phenylacetamide bromide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-phenylacetamide bromide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-phenyl-acetamide bromide Formula: C16H16BrN3O MolecularWeight: 346.22174

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1NC(=O)CC3=CC=CC=C3)N.[Br-]

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1NC(=O)CC3=CC=CC=C3)N.[Br-]

InChI

InChI=1S/C16H15N3O.BrH/c17-16-14-9-5-4-8-13(14)11-19(16)18-15(20)10-12-6-2-1-3-7-12;/h1-9,17H,10-11H2,(H,18,20);1H