2-cyclohexylethyl 3-chloranyl-4-(trioxidanylsulfanyl)benzoate

Systemtic Name: 2-cyclohexylethyl 3-chloranyl-4-(trioxidanylsulfanyl)benzoate Openeye Name: 2-cyclohexylethyl 3-chloro-4-(trioxidanylsulfanyl)benzoate CAS Name: 3-chloro-4-(trioxidanylthio)benzoic acid 2-cyclohexylethyl ester IUPAC Name: 2-cyclohexylethyl 3-chloro-4-(trioxidanylsulfanyl)benzoate Traditional Name: 3-chloro-4-(trioxidanylthio)benzoic acid 2-cyclohexylethyl ester Formula: C15H19ClO5S MolecularWeight: 346.82636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC(=O)C2=CC(=C(C=C2)SOOO)Cl

Isomeric SMILES

C1CCC(CC1)CCOC(=O)C2=CC(=C(C=C2)SOOO)Cl

InChI

InChI=1S/C15H19ClO5S/c16-13-10-12(6-7-14(13)22-21-20-18)15(17)19-9-8-11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9H2