1-adamantyl 3,5-bis(chloranyl)-2-phenylmethoxy-benzenesulfinate

Systemtic Name: 1-adamantyl 3,5-bis(chloranyl)-2-phenylmethoxy-benzenesulfinate Openeye Name: 1-adamantyl 2-benzyloxy-3,5-dichloro-benzenesulfinate CAS Name: 3,5-dichloro-2-phenylmethoxybenzenesulfinic acid 1-adamantyl ester IUPAC Name: 1-adamantyl 3,5-dichloro-2-phenylmethoxybenzenesulfinate Traditional Name: 2-benzoxy-3,5-dichloro-benzenesulfinic acid 1-adamantyl ester Formula: C23H24Cl2O3S MolecularWeight: 451.40586

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OS(=O)C4=CC(=CC(=C4OCC5=CC=CC=C5)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OS(=O)C4=CC(=CC(=C4OCC5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C23H24Cl2O3S/c24-19-9-20(25)22(27-14-15-4-2-1-3-5-15)21(10-19)29(26)28-23-11-16-6-17(12-23)8-18(7-16)13-23/h1-5,9-10,16-18H,6-8,11-14H2