4-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[bis(2-hydroxy-6-methyl-4-oxo-pyran-3-yl)methyl]benzonitrile CAS Name: 4-[bis(2-hydroxy-6-methyl-4-oxo-3-pyranyl)methyl]benzonitrile IUPAC Name: 4-[bis(2-hydroxy-6-methyl-4-oxopyran-3-yl)methyl]benzonitrile Traditional Name: 4-[bis(2-hydroxy-4-keto-6-methyl-pyran-3-yl)methyl]benzonitrile Formula: C20H15NO6 MolecularWeight: 365.3362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(C2=CC=C(C=C2)C#N)C3=C(OC(=CC3=O)C)O

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(C2=CC=C(C=C2)C#N)C3=C(OC(=CC3=O)C)O

InChI

InChI=1S/C20H15NO6/c1-10-7-14(22)17(19(24)26-10)16(13-5-3-12(9-21)4-6-13)18-15(23)8-11(2)27-20(18)25/h3-8,16,24-25H,1-2H3