(4-ethanoylphenyl) 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (4-acetylphenyl) 4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid (4-acetylphenyl) ester Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CSC3=C2CCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CSC3=C2CCCC3

InChI

InChI=1S/C17H16O3S/c1-11(18)12-6-8-13(9-7-12)20-17(19)15-10-21-16-5-3-2-4-14(15)16/h6-10H,2-5H2,1H3