3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)prop-2-ynoic acid

Systemtic Name: 3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)prop-2-ynoic acid Openeye Name: 3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)prop-2-ynoic acid CAS Name: 3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)-2-propynoic acid IUPAC Name: 3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)prop-2-ynoic acid Traditional Name: 3-(6,6-dimethyl-2,3-dihydrothiopyran-4-yl)propiolic acid Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(CCS1)C#CC(=O)O)C

Isomeric SMILES

CC1(C=C(CCS1)C#CC(=O)O)C

InChI

InChI=1S/C10H12O2S/c1-10(2)7-8(5-6-13-10)3-4-9(11)12/h7H,5-6H2,1-2H3,(H,11,12)