4-[(Z)-[4-oxidanylidene-3-(3-oxidanylidene-3-propoxy-propyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid

Systemtic Name: 4-[(Z)-[4-oxidanylidene-3-(3-oxidanylidene-3-propoxy-propyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[4-oxo-3-(3-oxo-3-propoxy-propyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(Z)-[4-oxo-3-(3-oxo-3-propoxypropyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[4-oxo-3-(3-oxo-3-propoxypropyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[4-keto-3-(3-keto-3-propoxy-propyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C17H17NO5S2 MolecularWeight: 379.45058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=S

Isomeric SMILES

CCCOC(=O)CCN1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)O)/SC1=S

InChI

InChI=1S/C17H17NO5S2/c1-2-9-23-14(19)7-8-18-15(20)13(25-17(18)24)10-11-3-5-12(6-4-11)16(21)22/h3-6,10H,2,7-9H2,1H3,(H,21,22)/b13-10-