4-chloranyl-5-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-(1,2-dihydroacenaphthylene-5-carbonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[1,2-dihydroacenaphthylen-5-yl(oxo)methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-(1,2-dihydroacenaphthylene-5-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 5-[4-(acenaphthene-5-carbonyl)piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C27H23ClN4O2 MolecularWeight: 470.95012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)N4CCN(CC4)C5=C(C(=O)N(N=C5)C6=CC=CC=C6)Cl

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)N4CCN(CC4)C5=C(C(=O)N(N=C5)C6=CC=CC=C6)Cl

InChI

InChI=1S/C27H23ClN4O2/c28-25-23(17-29-32(27(25)34)20-6-2-1-3-7-20)30-13-15-31(16-14-30)26(33)22-12-11-19-10-9-18-5-4-8-21(22)24(18)19/h1-8,11-12,17H,9-10,13-16H2