(3E)-3-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-5-(4-methylphenyl)furan-2-one

Systemtic Name: (3E)-3-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-5-(4-methylphenyl)furan-2-one Openeye Name: (3E)-3-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-5-(p-tolyl)furan-2-one CAS Name: (3E)-3-[[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylidene]-5-(4-methylphenyl)-2-furanone IUPAC Name: (3E)-3-[[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene]-5-(4-methylphenyl)furan-2-one Traditional Name: (3E)-3-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-5-(p-tolyl)furan-2-one Formula: C22H14BrNO5 MolecularWeight: 452.25426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Br)C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)C2=C/C(=C\C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Br)/C(=O)O2

InChI

InChI=1S/C22H14BrNO5/c1-13-2-4-14(5-3-13)21-11-15(22(25)29-21)10-17-7-9-20(28-17)18-8-6-16(24(26)27)12-19(18)23/h2-12H,1H3/b15-10+