1-(3-chloranylpropyl)-1-methyl-4-propyl-3,4-dihydroisothiochromene-6,7-diol

Systemtic Name: 1-(3-chloranylpropyl)-1-methyl-4-propyl-3,4-dihydroisothiochromene-6,7-diol Openeye Name: 1-(3-chloropropyl)-1-methyl-4-propyl-isothiochromane-6,7-diol CAS Name: 1-(3-chloropropyl)-1-methyl-4-propyl-3,4-dihydro-2-benzothiopyran-6,7-diol IUPAC Name: 1-(3-chloropropyl)-1-methyl-4-propyl-3,4-dihydroisothiochromene-6,7-diol Traditional Name: 1-(3-chloropropyl)-1-methyl-4-propyl-isothiochroman-6,7-diol Formula: C16H23ClO2S MolecularWeight: 314.87062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CSC(C2=CC(=C(C=C12)O)O)(C)CCCCl

Isomeric SMILES

CCCC1CSC(C2=CC(=C(C=C12)O)O)(C)CCCCl

InChI

InChI=1S/C16H23ClO2S/c1-3-5-11-10-20-16(2,6-4-7-17)13-9-15(19)14(18)8-12(11)13/h8-9,11,18-19H,3-7,10H2,1-2H3