tert-butyl 3-(hydroxymethyl)-4-thiophen-2-yl-butanoate

Systemtic Name: tert-butyl 3-(hydroxymethyl)-4-thiophen-2-yl-butanoate Openeye Name: tert-butyl 3-(hydroxymethyl)-4-(2-thienyl)butanoate CAS Name: 3-(hydroxymethyl)-4-thiophen-2-ylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(hydroxymethyl)-4-thiophen-2-ylbutanoate Traditional Name: 3-methylol-4-(2-thienyl)butyric acid tert-butyl ester Formula: C13H20O3S MolecularWeight: 256.3611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CC1=CC=CS1)CO

Isomeric SMILES

CC(C)(C)OC(=O)CC(CC1=CC=CS1)CO

InChI

InChI=1S/C13H20O3S/c1-13(2,3)16-12(15)8-10(9-14)7-11-5-4-6-17-11/h4-6,10,14H,7-9H2,1-3H3