(2E,4S)-4-methyl-2-(4-octoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: (2E,4S)-4-methyl-2-(4-octoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid Openeye Name: (2E,4S)-4-methyl-2-(4-octoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)thiazolidine-4-carboxylic acid CAS Name: (2E,4S)-4-methyl-2-(4-octoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-thiazolidinecarboxylic acid IUPAC Name: (2E,4S)-4-methyl-2-(4-octoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidine-4-carboxylic acid Traditional Name: (2E,4S)-2-(6-keto-4-octoxy-cyclohexa-2,4-dien-1-ylidene)-4-methyl-thiazolidine-4-carboxylic acid Formula: C19H27NO4S MolecularWeight: 365.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=O)C(=C2NC(CS2)(C)C(=O)O)C=C1

Isomeric SMILES

CCCCCCCCOC1=CC(=O)/C(=C/2\N[C@@](CS2)(C)C(=O)O)/C=C1

InChI

InChI=1S/C19H27NO4S/c1-3-4-5-6-7-8-11-24-14-9-10-15(16(21)12-14)17-20-19(2,13-25-17)18(22)23/h9-10,12,20H,3-8,11,13H2,1-2H3,(H,22,23)/b17-15+/t19-/m1/s1