3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylene)-4-oxo-1-phenyl-cyclohexanecarbonitrile CAS Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-1-phenylcyclohexane-1-carbonitrile Traditional Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-6-ylmethylene)-4-keto-1-phenyl-cyclohexanecarbonitrile Formula: C31H25NO5 MolecularWeight: 491.5339

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=C3CC(CC(=CC4=CC5=C(C=C4)OCCO5)C3=O)(C#N)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C=C3CC(CC(=CC4=CC5=C(C=C4)OCCO5)C3=O)(C#N)C6=CC=CC=C6

InChI

InChI=1S/C31H25NO5/c32-20-31(25-4-2-1-3-5-25)18-23(14-21-6-8-26-28(16-21)36-12-10-34-26)30(33)24(19-31)15-22-7-9-27-29(17-22)37-13-11-35-27/h1-9,14-17H,10-13,18-19H2