methyl 6-[4-(4-methylthiophen-2-yl)phenyl]-6-oxidanyl-hexanoate

Systemtic Name: methyl 6-[4-(4-methylthiophen-2-yl)phenyl]-6-oxidanyl-hexanoate Openeye Name: methyl 6-hydroxy-6-[4-(4-methyl-2-thienyl)phenyl]hexanoate CAS Name: 6-hydroxy-6-[4-(4-methyl-2-thiophenyl)phenyl]hexanoic acid methyl ester IUPAC Name: methyl 6-hydroxy-6-[4-(4-methylthiophen-2-yl)phenyl]hexanoate Traditional Name: 6-hydroxy-6-[4-(4-methyl-2-thienyl)phenyl]hexanoic acid methyl ester Formula: C18H22O3S MolecularWeight: 318.43048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=CC=C(C=C2)C(CCCCC(=O)OC)O

Isomeric SMILES

CC1=CSC(=C1)C2=CC=C(C=C2)C(CCCCC(=O)OC)O

InChI

InChI=1S/C18H22O3S/c1-13-11-17(22-12-13)15-9-7-14(8-10-15)16(19)5-3-4-6-18(20)21-2/h7-12,16,19H,3-6H2,1-2H3