5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)pentanoic acid

Systemtic Name: 5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)pentanoic acid Openeye Name: 5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)pentanoic acid CAS Name: 5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)pentanoic acid IUPAC Name: 5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)pentanoic acid Traditional Name: 5-(2,2-dimethyl-4H-1,3-dithiin-6-yl)valeric acid Formula: C11H18O2S2 MolecularWeight: 246.38942

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Descriptors Computed from Structure

Canonical SMILES:

CC1(SCC=C(S1)CCCCC(=O)O)C

Isomeric SMILES

CC1(SCC=C(S1)CCCCC(=O)O)C

InChI

InChI=1S/C11H18O2S2/c1-11(2)14-8-7-9(15-11)5-3-4-6-10(12)13/h7H,3-6,8H2,1-2H3,(H,12,13)