methyl 5-(2,5-ditert-butylthiophen-3-yl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(2,5-ditert-butylthiophen-3-yl)-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(2,5-ditert-butyl-3-thienyl)-5-oxo-pentanoate CAS Name: 5-(2,5-ditert-butyl-3-thiophenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2,5-ditert-butylthiophen-3-yl)-5-oxopentanoate Traditional Name: 5-(2,5-ditert-butyl-3-thienyl)-5-keto-valeric acid methyl ester Formula: C18H28O3S MolecularWeight: 324.47812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(C)(C)C)C(=O)CCCC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(C)(C)C)C(=O)CCCC(=O)OC

InChI

InChI=1S/C18H28O3S/c1-17(2,3)14-11-12(16(22-14)18(4,5)6)13(19)9-8-10-15(20)21-7/h11H,8-10H2,1-7H3