[4-oxidanylidene-4-(5-thiophen-2-ylthiophen-2-yl)butyl] 3-methylbutanoate

Systemtic Name: [4-oxidanylidene-4-(5-thiophen-2-ylthiophen-2-yl)butyl] 3-methylbutanoate Openeye Name: [4-oxo-4-[5-(2-thienyl)-2-thienyl]butyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-oxo-4-(5-thiophen-2-yl-2-thiophenyl)butyl] ester IUPAC Name: [4-oxo-4-(5-thiophen-2-ylthiophen-2-yl)butyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-keto-4-[5-(2-thienyl)-2-thienyl]butyl] ester Formula: C17H20O3S2 MolecularWeight: 336.4689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OCCCC(=O)C1=CC=C(S1)C2=CC=CS2

Isomeric SMILES

CC(C)CC(=O)OCCCC(=O)C1=CC=C(S1)C2=CC=CS2

InChI

InChI=1S/C17H20O3S2/c1-12(2)11-17(19)20-9-3-5-13(18)14-7-8-16(22-14)15-6-4-10-21-15/h4,6-8,10,12H,3,5,9,11H2,1-2H3