3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-propanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-oxo-propanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-oxopropanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-oxopropanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-(1,3-dithiol-2-ylidene)-3-keto-propionic acid Formula: C13H8O5S2 MolecularWeight: 308.32962

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C(=C3SC=CS3)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C(=C3SC=CS3)C(=O)O

InChI

InChI=1S/C13H8O5S2/c14-11(10(12(15)16)13-19-3-4-20-13)7-1-2-8-9(5-7)18-6-17-8/h1-5H,6H2,(H,15,16)