ethyl 3-[3-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanyl-phenyl]sulfanylbenzoate

Systemtic Name: ethyl 3-[3-(3-ethoxy-3-oxidanylidene-propyl)-4-oxidanyl-phenyl]sulfanylbenzoate Openeye Name: ethyl 3-[3-(3-ethoxy-3-oxo-propyl)-4-hydroxy-phenyl]sulfanylbenzoate CAS Name: 3-[[3-(3-ethoxy-3-oxopropyl)-4-hydroxyphenyl]thio]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(3-ethoxy-3-oxopropyl)-4-hydroxyphenyl]sulfanylbenzoate Traditional Name: 3-[[3-(3-ethoxy-3-keto-propyl)-4-hydroxy-phenyl]thio]benzoic acid ethyl ester Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)SC2=CC=CC(=C2)C(=O)OCC)O

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)SC2=CC=CC(=C2)C(=O)OCC)O

InChI

InChI=1S/C20H22O5S/c1-3-24-19(22)11-8-14-12-17(9-10-18(14)21)26-16-7-5-6-15(13-16)20(23)25-4-2/h5-7,9-10,12-13,21H,3-4,8,11H2,1-2H3