ethyl 4-(4-fluorophenyl)-5-(hydroxymethyl)-2-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-5-(hydroxymethyl)-2-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-5-(hydroxymethyl)-2-isopropyl-thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-5-(hydroxymethyl)-2-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-5-(hydroxymethyl)-2-propan-2-ylthiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-isopropyl-5-methylol-thiophene-3-carboxylic acid ethyl ester Formula: C17H19FO3S MolecularWeight: 322.394363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)F)CO)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)F)CO)C(C)C

InChI

InChI=1S/C17H19FO3S/c1-4-21-17(20)15-14(11-5-7-12(18)8-6-11)13(9-19)22-16(15)10(2)3/h5-8,10,19H,4,9H2,1-3H3