[2-(2,5-dimethylphenyl)-3-oxidanylidene-4-thiaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate

Systemtic Name: [2-(2,5-dimethylphenyl)-3-oxidanylidene-4-thiaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate Openeye Name: [2-(2,5-dimethylphenyl)-3-oxo-4-thiaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-(2,5-dimethylphenyl)-3-oxo-4-thiaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-3-oxo-4-thiaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-(2,5-dimethylphenyl)-3-keto-4-thiaspiro[4.5]dec-1-en-1-yl] ester Formula: C21H26O3S MolecularWeight: 358.49434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C3(CCCCC3)SC2=O)OC(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C3(CCCCC3)SC2=O)OC(=O)C(C)C

InChI

InChI=1S/C21H26O3S/c1-13(2)19(22)24-18-17(16-12-14(3)8-9-15(16)4)20(23)25-21(18)10-6-5-7-11-21/h8-9,12-13H,5-7,10-11H2,1-4H3