4-[oxan-2-yloxy-(4-oxidanylidene-3-phenylmethoxy-pyran-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[oxan-2-yloxy-(4-oxidanylidene-3-phenylmethoxy-pyran-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(3-benzyloxy-4-oxo-pyran-2-yl)-tetrahydropyran-2-yloxy-methyl]benzonitrile CAS Name: 4-[2-oxanyloxy-(4-oxo-3-phenylmethoxy-2-pyranyl)methyl]benzonitrile IUPAC Name: 4-[oxan-2-yloxy-(4-oxo-3-phenylmethoxypyran-2-yl)methyl]benzonitrile Traditional Name: 4-[(3-benzoxy-4-keto-pyran-2-yl)-tetrahydropyran-2-yloxy-methyl]benzonitrile Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC(C2=CC=C(C=C2)C#N)C3=C(C(=O)C=CO3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCOC(C1)OC(C2=CC=C(C=C2)C#N)C3=C(C(=O)C=CO3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23NO5/c26-16-18-9-11-20(12-10-18)23(31-22-8-4-5-14-28-22)25-24(21(27)13-15-29-25)30-17-19-6-2-1-3-7-19/h1-3,6-7,9-13,15,22-23H,4-5,8,14,17H2