3-(4-bromophenyl)carbonyl-5-[(4-methoxyphenyl)-oxidanyl-methylidene]-1H-pyrazol-4-one

Systemtic Name: 3-(4-bromophenyl)carbonyl-5-[(4-methoxyphenyl)-oxidanyl-methylidene]-1H-pyrazol-4-one Openeye Name: 3-(4-bromobenzoyl)-5-[hydroxy-(4-methoxyphenyl)methylene]-1H-pyrazol-4-one CAS Name: 3-[(4-bromophenyl)-oxomethyl]-5-[hydroxy-(4-methoxyphenyl)methylidene]-1H-pyrazol-4-one IUPAC Name: 3-(4-bromobenzoyl)-5-[hydroxy-(4-methoxyphenyl)methylidene]-1H-pyrazol-4-one Traditional Name: 3-(4-bromobenzoyl)-5-[hydroxy-(4-methoxyphenyl)methylene]-2-pyrazolin-4-one Formula: C18H13BrN2O4 MolecularWeight: 401.21082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C2C(=O)C(=NN2)C(=O)C3=CC=C(C=C3)Br)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=C2C(=O)C(=NN2)C(=O)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C18H13BrN2O4/c1-25-13-8-4-11(5-9-13)17(23)15-18(24)14(20-21-15)16(22)10-2-6-12(19)7-3-10/h2-9,21,23H,1H3