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

Systemtic Name: (E)-2-(1,3-dithiolan-2-ylidene)-5-(4-methylphenyl)-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-2-(1,3-dithiolan-2-ylidene)-3-oxo-5-(p-tolyl)pent-4-enoic acid CAS Name: (E)-2-(1,3-dithiolan-2-ylidene)-5-(4-methylphenyl)-3-oxo-4-pentenoic acid IUPAC Name: (E)-2-(1,3-dithiolan-2-ylidene)-5-(4-methylphenyl)-3-oxopent-4-enoic acid Traditional Name: (E)-2-(1,3-dithiolan-2-ylidene)-3-keto-5-(p-tolyl)pent-4-enoic acid Formula: C15H14O3S2 MolecularWeight: 306.39986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C(=C2SCCS2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C(=C2SCCS2)C(=O)O

InChI

InChI=1S/C15H14O3S2/c1-10-2-4-11(5-3-10)6-7-12(16)13(14(17)18)15-19-8-9-20-15/h2-7H,8-9H2,1H3,(H,17,18)/b7-6+