2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanethioic S-acid

Systemtic Name: 2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanethioic S-acid Openeye Name: 2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanethioic S-acid CAS Name: 2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanethioic S-acid IUPAC Name: 2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanethioic S-acid Traditional Name: 2-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]thioacetic acid Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)C2=CC=C(C=C2)CC(=O)S

Isomeric SMILES

CC1(OCCO1)C2=CC=C(C=C2)CC(=O)S

InChI

InChI=1S/C12H14O3S/c1-12(14-6-7-15-12)10-4-2-9(3-5-10)8-11(13)16/h2-5H,6-8H2,1H3,(H,13,16)