1-[(4-bromophenyl)methyl]-3-methyl-phthalazin-3-ium

Systemtic Name: 1-[(4-bromophenyl)methyl]-3-methyl-phthalazin-3-ium Openeye Name: 1-[(4-bromophenyl)methyl]-3-methyl-phthalazin-3-ium CAS Name: 1-[(4-bromophenyl)methyl]-3-methylphthalazin-3-ium IUPAC Name: 1-[(4-bromophenyl)methyl]-3-methylphthalazin-3-ium Traditional Name: 1-(4-bromobenzyl)-3-methyl-phthalazin-3-ium Formula: C16H14BrN2+ MolecularWeight: 314.19976

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC=CC=C2C(=N1)CC3=CC=C(C=C3)Br

Isomeric SMILES

C[N+]1=CC2=CC=CC=C2C(=N1)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN2/c1-19-11-13-4-2-3-5-15(13)16(18-19)10-12-6-8-14(17)9-7-12/h2-9,11H,10H2,1H3/q+1