5-(4-methylphenyl)-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 5-(4-methylphenyl)-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 5-(p-tolyl)-6-thioxo-cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 5-(4-methylphenyl)-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 5-(4-methylphenyl)-6-sulfanylidenecyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 5-(p-tolyl)-6-thioxo-cyclohexa-1,3-diene-1-carboxylic acid Formula: C14H12O2S MolecularWeight: 244.30888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C=CC=C(C2=S)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2C=CC=C(C2=S)C(=O)O

InChI

InChI=1S/C14H12O2S/c1-9-5-7-10(8-6-9)11-3-2-4-12(13(11)17)14(15)16/h2-8,11H,1H3,(H,15,16)