ethyl 4-[4-(4-ethoxyphenyl)-2-methanoyl-phenyl]sulfanylbutanoate

Systemtic Name: ethyl 4-[4-(4-ethoxyphenyl)-2-methanoyl-phenyl]sulfanylbutanoate Openeye Name: ethyl 4-[4-(4-ethoxyphenyl)-2-formyl-phenyl]sulfanylbutanoate CAS Name: 4-[[4-(4-ethoxyphenyl)-2-formylphenyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-ethoxyphenyl)-2-formylphenyl]sulfanylbutanoate Traditional Name: 4-[(2-formyl-4-p-phenetyl-phenyl)thio]butyric acid ethyl ester Formula: C21H24O4S MolecularWeight: 372.47786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=C(C=C2)SCCCC(=O)OCC)C=O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=C(C=C2)SCCCC(=O)OCC)C=O

InChI

InChI=1S/C21H24O4S/c1-3-24-19-10-7-16(8-11-19)17-9-12-20(18(14-17)15-22)26-13-5-6-21(23)25-4-2/h7-12,14-15H,3-6,13H2,1-2H3