5-(3,3-dimethyloxiran-2-yl)-6-ethynyl-1,3-benzodioxole

Systemtic Name: 5-(3,3-dimethyloxiran-2-yl)-6-ethynyl-1,3-benzodioxole Openeye Name: 5-(3,3-dimethyloxiran-2-yl)-6-ethynyl-1,3-benzodioxole CAS Name: 5-(3,3-dimethyl-2-oxiranyl)-6-ethynyl-1,3-benzodioxole IUPAC Name: 5-(3,3-dimethyloxiran-2-yl)-6-ethynyl-1,3-benzodioxole Traditional Name: 5-(3,3-dimethyloxiran-2-yl)-6-ethynyl-1,3-benzodioxole Formula: C13H12O3 MolecularWeight: 216.23258

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(O1)C2=CC3=C(C=C2C#C)OCO3)C

Isomeric SMILES

CC1(C(O1)C2=CC3=C(C=C2C#C)OCO3)C

InChI

InChI=1S/C13H12O3/c1-4-8-5-10-11(15-7-14-10)6-9(8)12-13(2,3)16-12/h1,5-6,12H,7H2,2-3H3