4-methyl-2-(3-methylbutoxy)-1,3-benzodithiole

Systemtic Name: 4-methyl-2-(3-methylbutoxy)-1,3-benzodithiole Openeye Name: 2-isopentyloxy-4-methyl-1,3-benzodithiole CAS Name: 4-methyl-2-(3-methylbutoxy)-1,3-benzodithiole IUPAC Name: 4-methyl-2-(3-methylbutoxy)-1,3-benzodithiole Traditional Name: 2-isoamoxy-4-methyl-1,3-benzodithiole Formula: C13H18OS2 MolecularWeight: 254.41142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(S2)OCCC(C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(S2)OCCC(C)C

InChI

InChI=1S/C13H18OS2/c1-9(2)7-8-14-13-15-11-6-4-5-10(3)12(11)16-13/h4-6,9,13H,7-8H2,1-3H3