(3E,6Z)-7-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)-2-methylidene-octa-3,6-dienoic acid

Systemtic Name: (3E,6Z)-7-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)-2-methylidene-octa-3,6-dienoic acid Openeye Name: (3E,6Z)-7-(4,4-dimethylthiochroman-6-yl)-2-methylene-octa-3,6-dienoic acid CAS Name: (3E,6Z)-7-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)-2-methyleneocta-3,6-dienoic acid IUPAC Name: (3E,6Z)-7-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)-2-methylideneocta-3,6-dienoic acid Traditional Name: (3E,6Z)-7-(4,4-dimethylthiochroman-6-yl)-2-methylene-octa-3,6-dienoic acid Formula: C20H24O2S MolecularWeight: 328.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC=CC(=C)C(=O)O)C1=CC2=C(C=C1)SCCC2(C)C

Isomeric SMILES

C/C(=C/C/C=C/C(=C)C(=O)O)/C1=CC2=C(C=C1)SCCC2(C)C

InChI

InChI=1S/C20H24O2S/c1-14(7-5-6-8-15(2)19(21)22)16-9-10-18-17(13-16)20(3,4)11-12-23-18/h6-10,13H,2,5,11-12H2,1,3-4H3,(H,21,22)/b8-6+,14-7-