1-(4-chlorophenyl)-3-[1-(3-nitrophenyl)carbonylpyrazol-3-yl]pyridazin-4-one

Systemtic Name: 1-(4-chlorophenyl)-3-[1-(3-nitrophenyl)carbonylpyrazol-3-yl]pyridazin-4-one Openeye Name: 1-(4-chlorophenyl)-3-[1-(3-nitrobenzoyl)pyrazol-3-yl]pyridazin-4-one CAS Name: 1-(4-chlorophenyl)-3-[1-[(3-nitrophenyl)-oxomethyl]-3-pyrazolyl]-4-pyridazinone IUPAC Name: 1-(4-chlorophenyl)-3-[1-(3-nitrobenzoyl)pyrazol-3-yl]pyridazin-4-one Traditional Name: 1-(4-chlorophenyl)-3-[1-(3-nitrobenzoyl)pyrazol-3-yl]pyridazin-4-one Formula: C20H12ClN5O4 MolecularWeight: 421.79338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C=CC(=N2)C3=NN(C=CC3=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C=CC(=N2)C3=NN(C=CC3=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H12ClN5O4/c21-14-4-6-15(7-5-14)24-11-9-18(27)19(23-24)17-8-10-25(22-17)20(28)13-2-1-3-16(12-13)26(29)30/h1-12H