methyl 3-[6-(oxan-2-yloxy)-2-thiophen-3-ylcarbonyl-1-benzofuran-3-yl]propanoate

Systemtic Name: methyl 3-[6-(oxan-2-yloxy)-2-thiophen-3-ylcarbonyl-1-benzofuran-3-yl]propanoate Openeye Name: methyl 3-[6-tetrahydropyran-2-yloxy-2-(thiophene-3-carbonyl)benzofuran-3-yl]propanoate CAS Name: 3-[6-(2-oxanyloxy)-2-[oxo(3-thiophenyl)methyl]-3-benzofuranyl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-(oxan-2-yloxy)-2-(thiophene-3-carbonyl)-1-benzofuran-3-yl]propanoate Traditional Name: 3-[6-tetrahydropyran-2-yloxy-2-(3-thenoyl)benzofuran-3-yl]propionic acid methyl ester Formula: C22H22O6S MolecularWeight: 414.47148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=C(OC2=C1C=CC(=C2)OC3CCCCO3)C(=O)C4=CSC=C4

Isomeric SMILES

COC(=O)CCC1=C(OC2=C1C=CC(=C2)OC3CCCCO3)C(=O)C4=CSC=C4

InChI

InChI=1S/C22H22O6S/c1-25-19(23)8-7-17-16-6-5-15(27-20-4-2-3-10-26-20)12-18(16)28-22(17)21(24)14-9-11-29-13-14/h5-6,9,11-13,20H,2-4,7-8,10H2,1H3