2,4-bis(chloranyl)-5-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid

Systemtic Name: 2,4-bis(chloranyl)-5-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid Openeye Name: 2,4-dichloro-5-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid CAS Name: 2,4-dichloro-5-[2-cyclohexylethoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 2,4-dichloro-5-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid Traditional Name: 2,4-dichloro-5-(2-cyclohexylethoxycarbonyl)besylic acid Formula: C15H18Cl2O5S MolecularWeight: 381.27142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)O

Isomeric SMILES

C1CCC(CC1)CCOC(=O)C2=CC(=C(C=C2Cl)Cl)S(=O)(=O)O

InChI

InChI=1S/C15H18Cl2O5S/c16-12-9-13(17)14(23(19,20)21)8-11(12)15(18)22-7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,19,20,21)