7-[4-oxidanylidene-2-[(E)-3-oxidanylidene-5-phenyl-pent-1-enyl]-1,3-thiazolidin-3-yl]heptanoic acid

Systemtic Name: 7-[4-oxidanylidene-2-[(E)-3-oxidanylidene-5-phenyl-pent-1-enyl]-1,3-thiazolidin-3-yl]heptanoic acid Openeye Name: 7-[4-oxo-2-[(E)-3-oxo-5-phenyl-pent-1-enyl]thiazolidin-3-yl]heptanoic acid CAS Name: 7-[4-oxo-2-[(E)-3-oxo-5-phenylpent-1-enyl]-3-thiazolidinyl]heptanoic acid IUPAC Name: 7-[4-oxo-2-[(E)-3-oxo-5-phenylpent-1-enyl]-1,3-thiazolidin-3-yl]heptanoic acid Traditional Name: 7-[4-keto-2-[(E)-3-keto-5-phenyl-pent-1-enyl]thiazolidin-3-yl]enanthic acid Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(S1)C=CC(=O)CCC2=CC=CC=C2)CCCCCCC(=O)O

Isomeric SMILES

C1C(=O)N(C(S1)/C=C/C(=O)CCC2=CC=CC=C2)CCCCCCC(=O)O

InChI

InChI=1S/C21H27NO4S/c23-18(12-11-17-8-4-3-5-9-17)13-14-20-22(19(24)16-27-20)15-7-2-1-6-10-21(25)26/h3-5,8-9,13-14,20H,1-2,6-7,10-12,15-16H2,(H,25,26)/b14-13+