4-chloranyl-5-[4-[4-(oxolan-2-ylmethoxy)phenyl]carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-[4-(oxolan-2-ylmethoxy)phenyl]carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[4-(tetrahydrofuran-2-ylmethoxy)benzoyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[oxo-[4-(2-oxolanylmethoxy)phenyl]methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-[4-(oxolan-2-ylmethoxy)benzoyl]piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[4-(tetrahydrofurfuryloxy)benzoyl]piperazino]pyridazin-3-one Formula: C26H27ClN4O4 MolecularWeight: 494.96998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C26H27ClN4O4/c27-24-23(17-28-31(26(24)33)20-5-2-1-3-6-20)29-12-14-30(15-13-29)25(32)19-8-10-21(11-9-19)35-18-22-7-4-16-34-22/h1-3,5-6,8-11,17,22H,4,7,12-16,18H2