4-butanoyl-5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)pyridazin-3-one

Systemtic Name: 4-butanoyl-5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)pyridazin-3-one Openeye Name: 4-butanoyl-5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)pyridazin-3-one CAS Name: 5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)-4-(1-oxobutyl)-3-pyridazinone IUPAC Name: 4-butanoyl-5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)pyridazin-3-one Traditional Name: 4-butyryl-5,6-bis(4-chlorophenyl)-2-(2-hydroxyethyl)pyridazin-3-one Formula: C22H20Cl2N2O3 MolecularWeight: 431.3118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C(=NN(C1=O)CCO)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC(=O)C1=C(C(=NN(C1=O)CCO)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20Cl2N2O3/c1-2-3-18(28)20-19(14-4-8-16(23)9-5-14)21(15-6-10-17(24)11-7-15)25-26(12-13-27)22(20)29/h4-11,27H,2-3,12-13H2,1H3