4-[4-(5,6,7-trimethoxy-2-oxidanylidene-chromen-4-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(5,6,7-trimethoxy-2-oxidanylidene-chromen-4-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(5,6,7-trimethoxy-2-oxo-chromen-4-yl)phenyl]benzonitrile CAS Name: 4-[4-(5,6,7-trimethoxy-2-oxo-1-benzopyran-4-yl)phenyl]benzonitrile IUPAC Name: 4-[4-(5,6,7-trimethoxy-2-oxochromen-4-yl)phenyl]benzonitrile Traditional Name: 4-[4-(2-keto-5,6,7-trimethoxy-chromen-4-yl)phenyl]benzonitrile Formula: C25H19NO5 MolecularWeight: 413.42206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=CC(=O)OC2=C1)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC)OC

InChI

InChI=1S/C25H19NO5/c1-28-21-13-20-23(25(30-3)24(21)29-2)19(12-22(27)31-20)18-10-8-17(9-11-18)16-6-4-15(14-26)5-7-16/h4-13H,1-3H3