3,3-dimethyl-7-prop-2-enyl-2H-1,4-benzoxathiine

Systemtic Name: 3,3-dimethyl-7-prop-2-enyl-2H-1,4-benzoxathiine Openeye Name: 7-allyl-3,3-dimethyl-2H-1,4-benzoxathiine CAS Name: 3,3-dimethyl-7-prop-2-enyl-2H-1,4-benzoxathiin IUPAC Name: 3,3-dimethyl-7-prop-2-enyl-2H-1,4-benzoxathiine Traditional Name: 7-allyl-3,3-dimethyl-2H-1,4-benzoxathiin Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(S1)C=CC(=C2)CC=C)C

Isomeric SMILES

CC1(COC2=C(S1)C=CC(=C2)CC=C)C

InChI

InChI=1S/C13H16OS/c1-4-5-10-6-7-12-11(8-10)14-9-13(2,3)15-12/h4,6-8H,1,5,9H2,2-3H3