ethyl 2-methyl-6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)thiopyran-3-carboxylate

Systemtic Name: ethyl 2-methyl-6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)thiopyran-3-carboxylate Openeye Name: ethyl 5-benzyl-6-hydroxy-2-methyl-4-oxo-thiopyran-3-carboxylate CAS Name: 6-hydroxy-2-methyl-4-oxo-5-(phenylmethyl)-3-thiopyrancarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-6-hydroxy-2-methyl-4-oxothiopyran-3-carboxylate Traditional Name: 5-benzyl-6-hydroxy-4-keto-2-methyl-thiopyran-3-carboxylic acid ethyl ester Formula: C16H16O4S MolecularWeight: 304.36084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C(C1=O)CC2=CC=CC=C2)O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C(C1=O)CC2=CC=CC=C2)O)C

InChI

InChI=1S/C16H16O4S/c1-3-20-15(18)13-10(2)21-16(19)12(14(13)17)9-11-7-5-4-6-8-11/h4-8,19H,3,9H2,1-2H3