6,8-ditert-butyl-2-(2-cyclopenta-2,4-dien-1-ylethynyl)-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxine

Systemtic Name: 6,8-ditert-butyl-2-(2-cyclopenta-2,4-dien-1-ylethynyl)-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxine Openeye Name: 6,8-ditert-butyl-2-(2-cyclopenta-2,4-dien-1-ylethynyl)-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxine CAS Name: 6,8-ditert-butyl-2-[2-(1-cyclopenta-2,4-dienyl)ethynyl]-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxin IUPAC Name: 6,8-ditert-butyl-2-(2-cyclopenta-2,4-dien-1-ylethynyl)-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxine Traditional Name: 6,8-ditert-butyl-2-(2-cyclopenta-2,4-dien-1-ylethynyl)-3a,9a-dimethyl-3H-cyclopenta[b][1,4]benzodioxin Formula: C28H34O2 MolecularWeight: 402.56836

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(=CC1(OC3=C(C=C(C=C3O2)C(C)(C)C)C(C)(C)C)C)C#CC4C=CC=C4

Isomeric SMILES

CC12CC(=CC1(OC3=C(C=C(C=C3O2)C(C)(C)C)C(C)(C)C)C)C#CC4C=CC=C4

InChI

InChI=1S/C28H34O2/c1-25(2,3)21-15-22(26(4,5)6)24-23(16-21)29-27(7)17-20(18-28(27,8)30-24)14-13-19-11-9-10-12-19/h9-12,15-16,18-19H,17H2,1-8H3