thiophen-2-ylmethyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: thiophen-2-ylmethyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: 2-thienylmethyl 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid thiophen-2-ylmethyl ester IUPAC Name: thiophen-2-ylmethyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid 2-thenyl ester Formula: C16H14O4S MolecularWeight: 302.34496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=CC=CS3

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=CC=CS3

InChI

InChI=1S/C16H14O4S/c1-10-13-8-11(18-2)5-6-14(13)20-15(10)16(17)19-9-12-4-3-7-21-12/h3-8H,9H2,1-2H3