(2-propan-2-ylphenyl) 4-piperidin-1-ylsulfonylbenzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 4-piperidin-1-ylsulfonylbenzenesulfonate Openeye Name: (2-isopropylphenyl) 4-(1-piperidylsulfonyl)benzenesulfonate CAS Name: 4-(1-piperidinylsulfonyl)benzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-piperidin-1-ylsulfonylbenzenesulfonate Traditional Name: 4-piperidinosulfonylbenzenesulfonic acid o-cumenyl ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H25NO5S2/c1-16(2)19-8-4-5-9-20(19)26-28(24,25)18-12-10-17(11-13-18)27(22,23)21-14-6-3-7-15-21/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3