2,4-bis(chloranyl)-4-methyl-cyclohexa-2,5-diene-1-carbothioic S-acid

Systemtic Name: 2,4-bis(chloranyl)-4-methyl-cyclohexa-2,5-diene-1-carbothioic S-acid Openeye Name: 2,4-dichloro-4-methyl-cyclohexa-2,5-diene-1-carbothioic S-acid CAS Name: 2,4-dichloro-4-methyl-1-cyclohexa-2,5-dienecarbothioic S-acid IUPAC Name: 2,4-dichloro-4-methylcyclohexa-2,5-diene-1-carbothioic S-acid Traditional Name: 2,4-dichloro-4-methyl-cyclohexa-2,5-diene-1-carbothioic S-acid Formula: C8H8Cl2OS MolecularWeight: 223.11952

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(C(=C1)Cl)C(=O)S)Cl

Isomeric SMILES

CC1(C=CC(C(=C1)Cl)C(=O)S)Cl

InChI

InChI=1S/C8H8Cl2OS/c1-8(10)3-2-5(7(11)12)6(9)4-8/h2-5H,1H3,(H,11,12)