N-(3-azanyl-1H-isoindol-2-ium-2-yl)-4-bromanyl-benzamide bromide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-4-bromanyl-benzamide bromide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-4-bromo-benzamide bromide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-4-bromobenzamide bromide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-4-bromobenzamide bromide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-4-bromo-benzamide bromide Formula: C15H13Br2N3O MolecularWeight: 411.09122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrN3O.BrH/c16-12-7-5-10(6-8-12)15(20)18-19-9-11-3-1-2-4-13(11)14(19)17;/h1-8,17H,9H2,(H,18,20);1H