2-(2-chloranyl-4-methyl-phenyl)-4-(methylsulfanylmethyl)cyclopentane-1,3-dione

Systemtic Name: 2-(2-chloranyl-4-methyl-phenyl)-4-(methylsulfanylmethyl)cyclopentane-1,3-dione Openeye Name: 2-(2-chloro-4-methyl-phenyl)-4-(methylsulfanylmethyl)cyclopentane-1,3-dione CAS Name: 2-(2-chloro-4-methylphenyl)-4-[(methylthio)methyl]cyclopentane-1,3-dione IUPAC Name: 2-(2-chloro-4-methylphenyl)-4-(methylsulfanylmethyl)cyclopentane-1,3-dione Traditional Name: 2-(2-chloro-4-methyl-phenyl)-4-[(methylthio)methyl]cyclopentane-1,3-quinone Formula: C14H15ClO2S MolecularWeight: 282.7857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(=O)CC(C2=O)CSC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2C(=O)CC(C2=O)CSC)Cl

InChI

InChI=1S/C14H15ClO2S/c1-8-3-4-10(11(15)5-8)13-12(16)6-9(7-18-2)14(13)17/h3-5,9,13H,6-7H2,1-2H3