[1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl] 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [1-(4-fluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-fluorophenyl)-1-oxopropan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid [2-(4-fluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H17FO3S MolecularWeight: 332.389183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)F)OC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)F)OC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C18H17FO3S/c1-11(17(20)12-6-8-14(19)9-7-12)22-18(21)16-10-13-4-2-3-5-15(13)23-16/h6-11H,2-5H2,1H3