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[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(6-oxidanyl-1-benzofuran-3-yl)ethanoate

[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(6-oxidanyl-1-benzofuran-3-yl)ethanoate

Systemtic Name:[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(6-oxidanyl-1-benzofuran-3-yl)ethanoate
Openeye Name:[(1S)-2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 2-(6-hydroxybenzofuran-3-yl)acetate
CAS Name:2-(6-hydroxy-3-benzofuranyl)acetic acid [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] ester
IUPAC Name:[(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 2-(6-hydroxy-1-benzofuran-3-yl)acetate
Traditional Name:2-(6-hydroxybenzofuran-3-yl)acetic acid [(1S)-2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester
Formula: C21H20O5
MolecularWeight: 352.3805
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CC2=COC3=C2C=CC(=C3)O


Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)CC2=COC3=C2C=CC(=C3)O


InChI

InChI=1S/C21H20O5/c1-3-14-4-6-15(7-5-14)21(24)13(2)26-20(23)10-16-12-25-19-11-17(22)8-9-18(16)19/h4-9,11-13,22H,3,10H2,1-2H3/t13-/m0/s1


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