5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoic acid Openeye Name: 5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-pent-4-enoic acid CAS Name: 5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-4-pentenoic acid IUPAC Name: 5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxopent-4-enoic acid Traditional Name: 5-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-pent-4-enoic acid Formula: C14H11ClO3S2 MolecularWeight: 326.81834

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(C(=O)C=CC2=CC=C(C=C2)Cl)C(=O)O)S1

Isomeric SMILES

C1CSC(=C(C(=O)C=CC2=CC=C(C=C2)Cl)C(=O)O)S1

InChI

InChI=1S/C14H11ClO3S2/c15-10-4-1-9(2-5-10)3-6-11(16)12(13(17)18)14-19-7-8-20-14/h1-6H,7-8H2,(H,17,18)