2-heptyl-2-methyl-1,3-benzodioxol-5-ol

Systemtic Name: 2-heptyl-2-methyl-1,3-benzodioxol-5-ol Openeye Name: 2-heptyl-2-methyl-1,3-benzodioxol-5-ol CAS Name: 2-heptyl-2-methyl-1,3-benzodioxol-5-ol IUPAC Name: 2-heptyl-2-methyl-1,3-benzodioxol-5-ol Traditional Name: 2-heptyl-2-methyl-sesamol Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(OC2=C(O1)C=C(C=C2)O)C

Isomeric SMILES

CCCCCCCC1(OC2=C(O1)C=C(C=C2)O)C

InChI

InChI=1S/C15H22O3/c1-3-4-5-6-7-10-15(2)17-13-9-8-12(16)11-14(13)18-15/h8-9,11,16H,3-7,10H2,1-2H3