2-[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)thiophen-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)thiophen-2-yl]sulfanylethanoic acid Openeye Name: 2-[[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)-2-thienyl]sulfanyl]acetic acid CAS Name: 2-[[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)-2-thiophenyl]thio]acetic acid IUPAC Name: 2-[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)thiophen-2-yl]sulfanylacetic acid Traditional Name: 2-[[5-(2-tert-butyl-5,5-dimethyl-1,3-dioxan-2-yl)-2-thienyl]thio]acetic acid Formula: C16H24O4S2 MolecularWeight: 344.48936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(C2=CC=C(S2)SCC(=O)O)C(C)(C)C)C

Isomeric SMILES

CC1(COC(OC1)(C2=CC=C(S2)SCC(=O)O)C(C)(C)C)C

InChI

InChI=1S/C16H24O4S2/c1-14(2,3)16(19-9-15(4,5)10-20-16)11-6-7-13(22-11)21-8-12(17)18/h6-7H,8-10H2,1-5H3,(H,17,18)