2-[(5Z)-5-[(3-methoxy-4-octoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(5Z)-5-[(3-methoxy-4-octoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(5Z)-5-[(3-methoxy-4-octoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-hydroxy-2-[(5Z)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-hydroxy-2-[(5Z)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-hydroxy-2-[(5Z)-4-keto-5-(3-methoxy-4-octoxy-benzylidene)-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C22H29NO6S2 MolecularWeight: 467.59876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C(CO)C(=O)O)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C(CO)C(=O)O)OC

InChI

InChI=1S/C22H29NO6S2/c1-3-4-5-6-7-8-11-29-17-10-9-15(12-18(17)28-2)13-19-20(25)23(22(30)31-19)16(14-24)21(26)27/h9-10,12-13,16,24H,3-8,11,14H2,1-2H3,(H,26,27)/b19-13-