4-bromanyl-2-phenyl-5-[4-(phenylmethyl)piperidin-1-yl]pyridazin-3-one

Systemtic Name: 4-bromanyl-2-phenyl-5-[4-(phenylmethyl)piperidin-1-yl]pyridazin-3-one Openeye Name: 5-(4-benzyl-1-piperidyl)-4-bromo-2-phenyl-pyridazin-3-one CAS Name: 4-bromo-2-phenyl-5-[4-(phenylmethyl)-1-piperidinyl]-3-pyridazinone IUPAC Name: 5-(4-benzylpiperidin-1-yl)-4-bromo-2-phenylpyridazin-3-one Traditional Name: 5-(4-benzylpiperidino)-4-bromo-2-phenyl-pyridazin-3-one Formula: C22H22BrN3O MolecularWeight: 424.33358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C22H22BrN3O/c23-21-20(16-24-26(22(21)27)19-9-5-2-6-10-19)25-13-11-18(12-14-25)15-17-7-3-1-4-8-17/h1-10,16,18H,11-15H2