2,6-bis(chloranyl)-3-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid

Systemtic Name: 2,6-bis(chloranyl)-3-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid Openeye Name: 2,6-dichloro-3-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid CAS Name: 2,6-dichloro-3-[2-cyclohexylethoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 2,6-dichloro-3-(2-cyclohexylethoxycarbonyl)benzenesulfonic acid Traditional Name: 2,6-dichloro-3-(2-cyclohexylethoxycarbonyl)besylic acid Formula: C15H18Cl2O5S MolecularWeight: 381.27142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18Cl2O5S/c16-12-7-6-11(13(17)14(12)23(19,20)21)15(18)22-9-8-10-4-2-1-3-5-10/h6-7,10H,1-5,8-9H2,(H,19,20,21)