ethyl 7-[2-oxidanylidene-4-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]-1,3-thiazolidin-3-yl]heptanoate

Systemtic Name: ethyl 7-[2-oxidanylidene-4-[(E)-3-oxidanyl-4-phenyl-but-1-enyl]-1,3-thiazolidin-3-yl]heptanoate Openeye Name: ethyl 7-[4-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-2-oxo-thiazolidin-3-yl]heptanoate CAS Name: 7-[4-[(E)-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-3-thiazolidinyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[4-[(E)-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]heptanoate Traditional Name: 7-[4-[(E)-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-thiazolidin-3-yl]enanthic acid ethyl ester Formula: C22H31NO4S MolecularWeight: 405.55084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN1C(CSC1=O)C=CC(CC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)CCCCCCN1C(CSC1=O)/C=C/C(CC2=CC=CC=C2)O

InChI

InChI=1S/C22H31NO4S/c1-2-27-21(25)12-8-3-4-9-15-23-19(17-28-22(23)26)13-14-20(24)16-18-10-6-5-7-11-18/h5-7,10-11,13-14,19-20,24H,2-4,8-9,12,15-17H2,1H3/b14-13+