(9Z)-5-oxidanylidene-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid

Systemtic Name: (9Z)-5-oxidanylidene-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid Openeye Name: (9Z)-5-oxo-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid CAS Name: (9Z)-5-oxo-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid IUPAC Name: (9Z)-5-oxo-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid Traditional Name: (9Z)-5-keto-2,3,4,6,7,8-hexahydro-1,4-thiazecine-3-carboxylic acid Formula: C9H13NO3S MolecularWeight: 215.26942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC=CSCC(NC(=O)C1)C(=O)O

Isomeric SMILES

C1C/C=C\SCC(NC(=O)C1)C(=O)O

InChI

InChI=1S/C9H13NO3S/c11-8-4-2-1-3-5-14-6-7(10-8)9(12)13/h3,5,7H,1-2,4,6H2,(H,10,11)(H,12,13)/b5-3-