(3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile

Systemtic Name: (3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile Openeye Name: (3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile CAS Name: (3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile IUPAC Name: (3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile Traditional Name: (3E,9Z)-12-phenylcyclododeca-3,9-diene-1,1-dicarbonitrile Formula: C20H22N2 MolecularWeight: 290.40208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC=CCC(C(CC=CC1)C2=CC=CC=C2)(C#N)C#N

Isomeric SMILES

C1CC/C=C/CC(C(C/C=C\C1)C2=CC=CC=C2)(C#N)C#N

InChI

InChI=1S/C20H22N2/c21-16-20(17-22)15-11-6-4-2-1-3-5-10-14-19(20)18-12-8-7-9-13-18/h5-13,19H,1-4,14-15H2/b10-5-,11-6+