2-(phenylmethyl)phthalazin-2-ium bromide

Systemtic Name: 2-(phenylmethyl)phthalazin-2-ium bromide Openeye Name: 2-benzylphthalazin-2-ium bromide CAS Name: 2-(phenylmethyl)phthalazin-2-ium bromide IUPAC Name: 2-benzylphthalazin-2-ium bromide Traditional Name: 2-benzylphthalazin-2-ium bromide Formula: C15H13BrN2 MolecularWeight: 301.18112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC3=CC=CC=C3C=N2.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC3=CC=CC=C3C=N2.[Br-]

InChI

InChI=1S/C15H13N2.BrH/c1-2-6-13(7-3-1)11-17-12-15-9-5-4-8-14(15)10-16-17;/h1-10,12H,11H2;1H/q+1;/p-1