methyl 5-(4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoate

Systemtic Name: methyl 5-(4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoate Openeye Name: methyl 5-(4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)pentanoate CAS Name: 5-(4-oxo-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoic acid methyl ester IUPAC Name: methyl 5-(4-oxo-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoate Traditional Name: 5-(4-keto-6,7-dihydro-5H-benzothiophen-2-yl)valeric acid methyl ester Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=CC2=C(S1)CCCC2=O

Isomeric SMILES

COC(=O)CCCCC1=CC2=C(S1)CCCC2=O

InChI

InChI=1S/C14H18O3S/c1-17-14(16)8-3-2-5-10-9-11-12(15)6-4-7-13(11)18-10/h9H,2-8H2,1H3