2-[[(2-bromophenyl)methyl-methyl-amino]methyl]phthalazin-1-one

Systemtic Name: 2-[[(2-bromophenyl)methyl-methyl-amino]methyl]phthalazin-1-one Openeye Name: 2-[[(2-bromophenyl)methyl-methyl-amino]methyl]phthalazin-1-one CAS Name: 2-[[(2-bromophenyl)methyl-methylamino]methyl]-1-phthalazinone IUPAC Name: 2-[[(2-bromophenyl)methyl-methylamino]methyl]phthalazin-1-one Traditional Name: 2-[[(2-bromobenzyl)-methyl-amino]methyl]phthalazin-1-one Formula: C17H16BrN3O MolecularWeight: 358.23244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CN(CC1=CC=CC=C1Br)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C17H16BrN3O/c1-20(11-14-7-3-5-9-16(14)18)12-21-17(22)15-8-4-2-6-13(15)10-19-21/h2-10H,11-12H2,1H3