[2-(3-iodanylpropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] methanoate

Systemtic Name: [2-(3-iodanylpropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] methanoate Openeye Name: [2-(3-iodopropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] formate CAS Name: formic acid [2-(3-iodopropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] ester IUPAC Name: [2-(3-iodopropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] formate Traditional Name: formic acid [2-(3-iodopropyl)-4,6,7-trimethyl-1,3-benzoxathiol-5-yl] ester Formula: C14H17IO3S MolecularWeight: 392.25245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1OC(S2)CCCI)C)OC=O)C

Isomeric SMILES

CC1=C(C(=C(C2=C1OC(S2)CCCI)C)OC=O)C

InChI

InChI=1S/C14H17IO3S/c1-8-9(2)13-14(10(3)12(8)17-7-16)19-11(18-13)5-4-6-15/h7,11H,4-6H2,1-3H3