2-[[4-[[5-(4-bromophenyl)-2-oxidanylidene-furan-3-ylidene]methyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[[5-(4-bromophenyl)-2-oxidanylidene-furan-3-ylidene]methyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[[5-(4-bromophenyl)-2-oxo-3-furylidene]methyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[[5-(4-bromophenyl)-2-oxo-3-furanylidene]methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[[5-(4-bromophenyl)-2-oxofuran-3-ylidene]methyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[[5-(4-bromophenyl)-2-keto-3-furylidene]methyl]phenoxy]methyl]benzonitrile Formula: C25H16BrNO3 MolecularWeight: 458.30344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C=C(OC3=O)C4=CC=C(C=C4)Br)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C=C(OC3=O)C4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C25H16BrNO3/c26-22-9-7-18(8-10-22)24-14-21(25(28)30-24)13-17-5-11-23(12-6-17)29-16-20-4-2-1-3-19(20)15-27/h1-14H,16H2