(2-methoxy-4-methoxycarbonyl-phenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-methoxy-4-methoxycarbonyl-phenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (2-methoxy-4-methoxycarbonyl-phenyl) 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (2-methoxy-4-methoxycarbonylphenyl) ester IUPAC Name: (2-methoxy-4-methoxycarbonylphenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (4-carbomethoxy-2-methoxy-phenyl) ester Formula: C18H18O5S MolecularWeight: 346.39752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C18H18O5S/c1-21-14-9-12(17(19)22-2)7-8-13(14)23-18(20)16-10-11-5-3-4-6-15(11)24-16/h7-10H,3-6H2,1-2H3