5-[4-[[2,3-bis(chloranyl)phenyl]methyl]piperazin-1-yl]-2-phenyl-4-phenylmethoxy-pyridazin-3-one

Systemtic Name: 5-[4-[[2,3-bis(chloranyl)phenyl]methyl]piperazin-1-yl]-2-phenyl-4-phenylmethoxy-pyridazin-3-one Openeye Name: 4-benzyloxy-5-[4-[(2,3-dichlorophenyl)methyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(2,3-dichlorophenyl)methyl]-1-piperazinyl]-2-phenyl-4-phenylmethoxy-3-pyridazinone IUPAC Name: 5-[4-[(2,3-dichlorophenyl)methyl]piperazin-1-yl]-2-phenyl-4-phenylmethoxypyridazin-3-one Traditional Name: 4-benzoxy-5-[4-(2,3-dichlorobenzyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C28H26Cl2N4O2 MolecularWeight: 521.43764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C(=CC=C2)Cl)Cl)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=C(C(=CC=C2)Cl)Cl)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H26Cl2N4O2/c29-24-13-7-10-22(26(24)30)19-32-14-16-33(17-15-32)25-18-31-34(23-11-5-2-6-12-23)28(35)27(25)36-20-21-8-3-1-4-9-21/h1-13,18H,14-17,19-20H2