[2,6-bis(oxidanylidene)cyclohexylidene]-(2-chloranyl-4-methylsulfonyl-phenyl)methanolate

Systemtic Name: [2,6-bis(oxidanylidene)cyclohexylidene]-(2-chloranyl-4-methylsulfonyl-phenyl)methanolate Openeye Name: (2-chloro-4-methylsulfonyl-phenyl)-(2,6-dioxocyclohexylidene)methanolate CAS Name: (2-chloro-4-methylsulfonylphenyl)-(2,6-dioxocyclohexylidene)methanolate IUPAC Name: (2-chloro-4-methylsulfonylphenyl)-(2,6-dioxocyclohexylidene)methanolate Traditional Name: (2-chloro-4-mesyl-phenyl)-(2,6-diketocyclohexylidene)methanolate Formula: C14H12ClO5S- MolecularWeight: 327.76008

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C(=C2C(=O)CCCC2=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C(=C2C(=O)CCCC2=O)[O-])Cl

InChI

InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,18H,2-4H2,1H3/p-1