(E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoate

Systemtic Name: (E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoate Openeye Name: (E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-pent-4-enoate CAS Name: (E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-4-pentenoate IUPAC Name: (E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxopent-4-enoate Traditional Name: (E)-5-(3,4-dimethoxyphenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-pent-4-enoate Formula: C16H15O5S2- MolecularWeight: 351.4173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C(=C2SCCS2)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C(=C2SCCS2)C(=O)[O-])OC

InChI

InChI=1S/C16H16O5S2/c1-20-12-6-4-10(9-13(12)21-2)3-5-11(17)14(15(18)19)16-22-7-8-23-16/h3-6,9H,7-8H2,1-2H3,(H,18,19)/p-1/b5-3+