4-chloranyl-5-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-phenyl-pyridazin-3-one Formula: C18H15ClN4O4 MolecularWeight: 386.7891

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C18H15ClN4O4/c19-17-15(10-21-22(18(17)25)13-4-2-1-3-5-13)20-11-16(24)12-6-8-14(9-7-12)23(26)27/h1-10,16,20,24H,11H2