bis(1-adamantyl)-thieno[3,4-d][1,3]dioxol-4-yl-methanol

Systemtic Name: bis(1-adamantyl)-thieno[3,4-d][1,3]dioxol-4-yl-methanol Openeye Name: bis(1-adamantyl)-thieno[3,4-d][1,3]dioxol-4-yl-methanol CAS Name: bis(1-adamantyl)-(4-thieno[3,4-d][1,3]dioxolyl)methanol IUPAC Name: bis(1-adamantyl)-thieno[3,4-d][1,3]dioxol-4-ylmethanol Traditional Name: bis(1-adamantyl)-thieno[3,4-d][1,3]dioxol-4-yl-methanol Formula: C26H34O3S MolecularWeight: 426.61136

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C4=C5C(=CS4)OCO5)(C67CC8CC(C6)CC(C8)C7)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(C4=C5C(=CS4)OCO5)(C67CC8CC(C6)CC(C8)C7)O

InChI

InChI=1S/C26H34O3S/c27-26(23-22-21(13-30-23)28-14-29-22,24-7-15-1-16(8-24)3-17(2-15)9-24)25-10-18-4-19(11-25)6-20(5-18)12-25/h13,15-20,27H,1-12,14H2