methyl 4-[4-[oxidanyl(thiophen-2-yl)methyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[oxidanyl(thiophen-2-yl)methyl]phenyl]butanoate Openeye Name: methyl 4-[4-[hydroxy(2-thienyl)methyl]phenyl]butanoate CAS Name: 4-[4-[hydroxy(thiophen-2-yl)methyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[hydroxy(thiophen-2-yl)methyl]phenyl]butanoate Traditional Name: 4-[4-[hydroxy(2-thienyl)methyl]phenyl]butyric acid methyl ester Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(C2=CC=CS2)O

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(C2=CC=CS2)O

InChI

InChI=1S/C16H18O3S/c1-19-15(17)6-2-4-12-7-9-13(10-8-12)16(18)14-5-3-11-20-14/h3,5,7-11,16,18H,2,4,6H2,1H3