4-azanyl-1,3-bis(oxidanylidene)-6-phenyl-7-(4-phenylphenyl)-2-benzofuran-5-carbonitrile

Systemtic Name: 4-azanyl-1,3-bis(oxidanylidene)-6-phenyl-7-(4-phenylphenyl)-2-benzofuran-5-carbonitrile Openeye Name: 4-amino-1,3-dioxo-6-phenyl-7-(4-phenylphenyl)isobenzofuran-5-carbonitrile CAS Name: 4-amino-1,3-dioxo-6-phenyl-7-(4-phenylphenyl)-5-isobenzofurancarbonitrile IUPAC Name: 4-amino-1,3-dioxo-6-phenyl-7-(4-phenylphenyl)-2-benzofuran-5-carbonitrile Traditional Name: 4-amino-1,3-diketo-6-phenyl-7-(4-phenylphenyl)phthalan-5-carbonitrile Formula: C27H16N2O3 MolecularWeight: 416.42754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C(=C(C(=C3C5=CC=CC=C5)C#N)N)C(=O)OC4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C(=C(C(=C3C5=CC=CC=C5)C#N)N)C(=O)OC4=O

InChI

InChI=1S/C27H16N2O3/c28-15-20-21(18-9-5-2-6-10-18)22(23-24(25(20)29)27(31)32-26(23)30)19-13-11-17(12-14-19)16-7-3-1-4-8-16/h1-14H,29H2