methyl 8-[5-(4-methoxy-4-oxidanylidene-butanoyl)thiophen-2-yl]octanoate

Systemtic Name: methyl 8-[5-(4-methoxy-4-oxidanylidene-butanoyl)thiophen-2-yl]octanoate Openeye Name: methyl 8-[5-(4-methoxy-4-oxo-butanoyl)-2-thienyl]octanoate CAS Name: 8-[5-(4-methoxy-1,4-dioxobutyl)-2-thiophenyl]octanoic acid methyl ester IUPAC Name: methyl 8-[5-(4-methoxy-4-oxobutanoyl)thiophen-2-yl]octanoate Traditional Name: 8-[5-(4-keto-4-methoxy-butanoyl)-2-thienyl]caprylic acid methyl ester Formula: C18H26O5S MolecularWeight: 354.46104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCC1=CC=C(S1)C(=O)CCC(=O)OC

Isomeric SMILES

COC(=O)CCCCCCCC1=CC=C(S1)C(=O)CCC(=O)OC

InChI

InChI=1S/C18H26O5S/c1-22-17(20)9-7-5-3-4-6-8-14-10-12-16(24-14)15(19)11-13-18(21)23-2/h10,12H,3-9,11,13H2,1-2H3