4-(4-bromophenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one

Systemtic Name: 4-(4-bromophenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one Openeye Name: 4-(4-bromophenyl)-2-[(4-methyl-1-piperidyl)methyl]phthalazin-1-one CAS Name: 4-(4-bromophenyl)-2-[(4-methyl-1-piperidinyl)methyl]-1-phthalazinone IUPAC Name: 4-(4-bromophenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one Traditional Name: 4-(4-bromophenyl)-2-[(4-methylpiperidino)methyl]phthalazin-1-one Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H22BrN3O/c1-15-10-12-24(13-11-15)14-25-21(26)19-5-3-2-4-18(19)20(23-25)16-6-8-17(22)9-7-16/h2-9,15H,10-14H2,1H3