(4E)-2-(4-bromophenyl)-5-methyl-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Openeye Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-3-one CAS Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furanyl]methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[[5-(3-oxo-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Traditional Name: (4E)-2-(4-bromophenyl)-4-[[5-(3-ketophthalan-5-yl)-2-furyl]methylene]-5-methyl-2-pyrazolin-3-one Formula: C23H15BrN2O4 MolecularWeight: 463.2802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC4=C(COC4=O)C=C3)C5=CC=C(C=C5)Br

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=CC4=C(COC4=O)C=C3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C23H15BrN2O4/c1-13-19(22(27)26(25-13)17-6-4-16(24)5-7-17)11-18-8-9-21(30-18)14-2-3-15-12-29-23(28)20(15)10-14/h2-11H,12H2,1H3/b19-11+