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

Systemtic Name: (4E)-2-(3-bromophenyl)-5-methyl-4-[[5-(1-oxidanylidene-3H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Openeye Name: (4E)-2-(3-bromophenyl)-5-methyl-4-[[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-3-one CAS Name: (4E)-2-(3-bromophenyl)-5-methyl-4-[[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furanyl]methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(3-bromophenyl)-5-methyl-4-[[5-(1-oxo-3H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Traditional Name: (4E)-2-(3-bromophenyl)-4-[[5-(1-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(C=C3)C(=O)OC4)C5=CC(=CC=C5)Br

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=CC4=C(C=C3)C(=O)OC4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C23H15BrN2O4/c1-13-20(22(27)26(25-13)17-4-2-3-16(24)10-17)11-18-6-8-21(30-18)14-5-7-19-15(9-14)12-29-23(19)28/h2-11H,12H2,1H3/b20-11+