ethyl (3E,5Z)-6-ethoxy-6-oxidanyl-2-oxidanylidene-5-[(4-phenylphenyl)methylsulfanyl]hexa-3,5-dienoate

Systemtic Name: ethyl (3E,5Z)-6-ethoxy-6-oxidanyl-2-oxidanylidene-5-[(4-phenylphenyl)methylsulfanyl]hexa-3,5-dienoate Openeye Name: ethyl (3E,5Z)-6-ethoxy-6-hydroxy-2-oxo-5-[(4-phenylphenyl)methylsulfanyl]hexa-3,5-dienoate CAS Name: (3E,5Z)-6-ethoxy-6-hydroxy-2-oxo-5-[(4-phenylphenyl)methylthio]hexa-3,5-dienoic acid ethyl ester IUPAC Name: ethyl (3E,5Z)-6-ethoxy-6-hydroxy-2-oxo-5-[(4-phenylphenyl)methylsulfanyl]hexa-3,5-dienoate Traditional Name: (3E,5Z)-6-ethoxy-6-hydroxy-2-keto-5-[(4-phenylbenzyl)thio]hexa-3,5-dienoic acid ethyl ester Formula: C23H24O5S MolecularWeight: 412.49866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C=CC(=O)C(=O)OCC)SCC1=CC=C(C=C1)C2=CC=CC=C2)O

Isomeric SMILES

CCO/C(=C(/C=C/C(=O)C(=O)OCC)\SCC1=CC=C(C=C1)C2=CC=CC=C2)/O

InChI

InChI=1S/C23H24O5S/c1-3-27-22(25)20(24)14-15-21(23(26)28-4-2)29-16-17-10-12-19(13-11-17)18-8-6-5-7-9-18/h5-15,26H,3-4,16H2,1-2H3/b15-14+,23-21-