[2-methoxy-4-(3-oxidanylidenebutyl)phenyl] thiophene-2-carboxylate

Systemtic Name: [2-methoxy-4-(3-oxidanylidenebutyl)phenyl] thiophene-2-carboxylate Openeye Name: [2-methoxy-4-(3-oxobutyl)phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-methoxy-4-(3-oxobutyl)phenyl] ester IUPAC Name: [2-methoxy-4-(3-oxobutyl)phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-(3-ketobutyl)-2-methoxy-phenyl] ester Formula: C16H16O4S MolecularWeight: 304.36084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C=C1)OC(=O)C2=CC=CS2)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C=C1)OC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C16H16O4S/c1-11(17)5-6-12-7-8-13(14(10-12)19-2)20-16(18)15-4-3-9-21-15/h3-4,7-10H,5-6H2,1-2H3