2-(2-methyl-4-oxidanylidene-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)ethanoic acid

Systemtic Name: 2-(2-methyl-4-oxidanylidene-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)ethanoic acid Openeye Name: 2-(2-methyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetic acid CAS Name: 2-(2-methyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetic acid IUPAC Name: 2-(2-methyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetic acid Traditional Name: 2-(4-keto-2-methyl-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetic acid Formula: C11H12O3S2 MolecularWeight: 256.34118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)SCCC(C2=O)CC(=O)O

Isomeric SMILES

CC1=CC2=C(S1)SCCC(C2=O)CC(=O)O

InChI

InChI=1S/C11H12O3S2/c1-6-4-8-10(14)7(5-9(12)13)2-3-15-11(8)16-6/h4,7H,2-3,5H2,1H3,(H,12,13)